SCHEMBL13367454

SCHEMBL13367454

CN(c1ccc(-c2ccc3ccccc3c2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 7/20 0.46
▸ LPL P06858 1/20 0.39
▸ LIPG Q9Y5X9 1/20 0.39
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ GSTP1 P09211 1/20 0.34
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ MLNR O43193 1/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ ADRB1 P08588 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ ADRA2B P18089 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22807871 0.92 PDK2 (0.44) PDK2LPLLIPGPGRHSD17B1
SCHEMBL20091190 0.91 PDK2 (0.40) PDK2LPLLIPGESR1ESR2
SCHEMBL12715088 0.90 PDK2 (0.48) PDK2SLC6A2SLC6A4MLNRNR1I2
SCHEMBL24686801 0.88 LPL (0.40) PDK2LPLLIPGESR1ESR2
SCHEMBL20466609 0.88 LPL (0.40) PDK2LPLLIPGESR1ESR2
SCHEMBL10034405 0.88 LPL (0.40) PDK2LPLLIPGESR1ESR2
SCHEMBL10819249 0.88 PDK2 (0.55) PDK2SLC6A2SLC6A4MLNRNR1I2
SCHEMBL19627431 0.88 PDK2 (0.55) PDK2SLC6A2SLC6A4MLNRNR1I2
SCHEMBL19735311 0.88 PDK2 (0.55) PDK2SLC6A2SLC6A4MLNRNR1I2
SCHEMBL10034344 0.87 LPL (0.39) PDK2LPLLIPGESR1ESR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same LG CHEM, LTD. 2020-12-22 — — US disclosed
US-10800969-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-10-13 — — US disclosed
US-10730812-B2 Double spiro compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2020-08-04 — — US disclosed
US-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 — — US disclosed
US-10421721-B2 Heterocyclic compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2019-09-24 — — US disclosed
US-10294203-B2 Organic compound and electronic device comprising an organic layer comprising the organic compound DOW GLOBAL TECHNOLOGIES LLC (US) 2019-05-21 — — US disclosed
WO-2018119729-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND DOW GLOBAL TECHNOLOGIES LLC (US) 2018-07-05 — — WO disclosed
US-10005729-B2 Organic compounds and electronic device comprising an organic layer comprising the organic compounds ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2018-06-26 — — US disclosed
US-10005729-B2 Organic compounds and electronic device comprising an organic layer comprising the organic compounds ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2018-06-26 — — US disclosed
US-20180148641-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 — — US disclosed
EP-3291323-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2018-03-07 — — EP disclosed
US-20180037547-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-02-08 — — US disclosed
US-20180037547-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-02-08 — — US disclosed
US-20180006236-A1 ORGANIC COMPOUNDS AND ELECTRONIC DEVICE COMPRISING ORGANIC LAYER COMPRISING ORGANIC COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2018-01-04 — — US disclosed
US-20180002284-A1 ORGANIC COMPOUNDS AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC 2018-01-04 — — US disclosed
US-20170365787-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2017-12-21 — — US disclosed
US-20170365787-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2017-12-21 — — US disclosed
US-20170334849-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND DOW GLOBAL TECHNOLOGIES LLC (US) 2017-11-23 — — US disclosed
US-20170334849-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND DOW GLOBAL TECHNOLOGIES LLC (US) 2017-11-23 — — US disclosed
US-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-05-06 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170334849-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND OR10J3, OCIAD2, OCIAD1 PDK2 2410/4885LPL 1767/4885LIPG 1186/4885
US-10800969-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 PDK2 2769/4885LPL 2295/4885LIPG 2733/4885
US-10005729-B2 Organic compounds and electronic device comprising an organic layer comprising the organic compounds EPCAM, OR10J3, EML4 PDK2 1881/4885LPL 2080/4885LIPG 1125/4885
US-20180002284-A1 ORGANIC COMPOUNDS AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUNDS EPCAM, OR10J3, EML4 PDK2 1881/4885LPL 2080/4885LIPG 1125/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 PDK2 2535/4885LPL 1666/4885LIPG 1838/4885
US-10421721-B2 Heterocyclic compound and organic light emitting device comprising same CRY1, CRY2, PER2 PDK2 2326/4885LPL 2016/4885LIPG 2324/4885
US-20180037547-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CRY2, PER2 PDK2 2326/4885LPL 2016/4885LIPG 2324/4885
US-10294203-B2 Organic compound and electronic device comprising an organic layer comprising the organic compound OR10J3, OCIAD2, OCIAD1 PDK2 2410/4885LPL 1767/4885LIPG 1186/4885
US-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OR10J3, OCIAD1, OCIAD2 PDK2 2885/4885LPL 1774/4885LIPG 2846/4885
US-20180148641-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 PDK2 2374/4885LPL 2577/4885LIPG 3047/4885
US-20180006236-A1 ORGANIC COMPOUNDS AND ELECTRONIC DEVICE COMPRISING ORGANIC LAYER COMPRISING ORGANIC COMPOUNDS OR10J3, OCIAD2, VDAC2 PDK2 1510/4885LPL 1067/4885LIPG 666/4885
US-10730812-B2 Double spiro compound and organic light-emitting element comprising same NR2E3, CRY1, CRY2 PDK2 564/4885LPL 1423/4885LIPG 3025/4885
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same CRY1, CRY2, PER2 PDK2 1602/4885LPL 2390/4885LIPG 2854/4885
US-20170365787-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, NR2E3, LEF1 PDK2 888/4885LPL 2394/4885LIPG 3747/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback