Sugi Predict

Sugi Predict / Compounds / SCHEMBL17755350

SCHEMBL17755350

SCHEMBL17755350

c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3cc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)ccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 3/20 0.49
▸ ESR2 Q92731 3/20 0.49
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ GRIA1 P42261 1/20 0.43
▸ CACNG8 Q8WXS5 1/20 0.43
▸ CACNG2 Q9Y698 1/20 0.43
▸ PTGER4 P35408 1/20 0.42
▸ MAPK10 P53779 5/20 0.42
▸ HTT P42858 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL17755355 1.00 ESR1 (0.49) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL24813302 1.00 ESR1 (0.49) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL25668081 1.00 ESR1 (0.49) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL12571663 0.99 ESR1 (0.47) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL12571687 0.99 ESR1 (0.47) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL24813309 0.99 ESR1 (0.50) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL20906742 0.98 ESR1 (0.52) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL25668147 0.98 ESR1 (0.52) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL17932821 0.98 ESR1 (0.52) ESR1ESR2MEN1KMT2AHSP90AA1
SCHEMBL18999456 0.98 ESR1 (0.51) ESR1ESR2MEN1KMT2AHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 — — US disclosed
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 — — US disclosed
EP-4212535-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME Lg Chem, Ltd. (KR) 2023-07-19 — — EP disclosed
US-11685751-B2 Compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2023-06-27 — — US disclosed
US-11685751-B2 Compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2023-06-27 — — US disclosed
US-20220402887-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2022-12-22 — — US disclosed
US-20220263027-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2022-08-18 — — US disclosed
US-20220153758-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2022-05-19 — — US disclosed
WO-2022103090-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-05-19 — — WO disclosed
US-20210391547-A1 BORON-CONTAINING COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2021-12-16 — — US disclosed
WO-2021107678-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO disclosed
WO-2021049889-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-03-18 — — WO disclosed
WO-2021020928-A2 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-02-04 — — WO disclosed
WO-2021020929-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-02-04 — — WO disclosed
WO-2020167001-A1 BORON-CONTAINING COMPOUND, AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2020-08-20 — — WO disclosed
WO-2020149716-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-07-23 — — WO disclosed
US-9490434-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-08 — — US disclosed
US-9490434-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-08 — — US disclosed
US-20160141519-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-19 — — US disclosed
US-20160141519-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-19 — — 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 (6 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-20220263027-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CYP1A1, AOX1, ARNT ESR1 103/4885ESR2 279/4885MEN1 2176/4885
US-20220153758-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CCNY, CDYL, NR1H2 ESR1 128/4885ESR2 104/4885MEN1 3764/4885
US-20220402887-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 ESR1 63/4885ESR2 244/4885MEN1 240/4885
US-11780856-B2 Compound and organic light-emitting device comprising same CRY1, CRY2, LEF1 ESR1 141/4885ESR2 743/4885MEN1 449/4885
US-20210391547-A1 BORON-CONTAINING COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, POU2F1, LEF1 ESR1 18/4885ESR2 158/4885MEN1 566/4885
US-11685751-B2 Compound and organic light-emitting element comprising same CRY1, CRY2, LEF1 ESR1 31/4885ESR2 206/4885MEN1 459/4885

“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.