SCHEMBL12070874

SCHEMBL12070874

CC(C)c1nc2ccccc2c2nc3ccccc3n12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.64
▸ MAPT P10636 4/20 0.64
▸ LMNA P02545 3/20 0.64
▸ TP53 P04637 2/20 0.64
▸ POLB P06746 2/20 0.64
▸ HSD17B10 Q99714 2/20 0.64
▸ HPGD P15428 6/20 0.59
▸ ALDH1A1 P00352 5/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ CNR2 P34972 1/20 0.47
▸ TDP1 Q9NUW8 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP7 P55210 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HIF1A Q16665 1/20 0.46

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
SCHEMBL12071697 0.88 KDM4E (0.65) KDM4EMAPTLMNATP53POLB
SCHEMBL10483331 0.85 KDM4E (0.57) KDM4EMAPTLMNATP53POLB
SCHEMBL12071695 0.85 KDM4E (0.61) KDM4EMAPTLMNATP53POLB
SCHEMBL12070876 0.85 KDM4E (0.61) KDM4EMAPTLMNATP53POLB
SCHEMBL12070862 0.83 KDM4E (0.63) KDM4EMAPTLMNATP53POLB
SCHEMBL12070879 0.83 KDM4E (0.62) KDM4EMAPTLMNATP53POLB
SCHEMBL12070878 0.83 KDM4E (0.60) KDM4EMAPTLMNATP53POLB
SCHEMBL12070875 0.81 KDM4E (0.56) KDM4EMAPTLMNATP53POLB
SCHEMBL10513812 0.78 KDM4E (1.00) KDM4EMAPTLMNATP53POLB
SCHEMBL12072882 0.78 HPGD (0.67) KDM4EMAPTLMNATP53POLB

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981876-B2 Spiro compound and organic light emitting element comprising same LG CHEM, LTD. 2021-04-20 — — US disclosed
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2020-03-03 — — US disclosed
US-10577355-B2 Hetero ring compound and organic luminescent element comprising same LG CHEM, LTD. (KR) 2020-03-03 — — US disclosed
US-10263193-B2 Heterocyclic compound and organic light-emitting element using same LG CHEM, LTD. (KR) 2019-04-16 — — US disclosed
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 — — US disclosed
US-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-17 — — US disclosed
US-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-17 — — US disclosed
WO-2017034303-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2017-03-02 — — WO disclosed
US-9273080-B2 Metal complexes MEREK PATENT GMBH (DE) 2016-03-01 — — US disclosed
US-9273080-B2 Metal complexes MEREK PATENT GMBH (DE) 2016-03-01 — — US disclosed
US-20130082209-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-04-04 — — US disclosed
US-20130082209-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-04-04 — — US disclosed
WO-2011157339-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2011-12-22 — — WO 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 (7 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-10263193-B2 Heterocyclic compound and organic light-emitting element using same CRY1, NFE2L2, CRY2 KDM4E 2254/4885MAPT 1113/4885LMNA 2568/4885
US-10981876-B2 Spiro compound and organic light emitting element comprising same RER1, RIF1, CRY1 KDM4E 3645/4885MAPT 1866/4885LMNA 1310/4885
US-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY2, NR2E3, CRY1 KDM4E 1570/4885MAPT 530/4885LMNA 2374/4885
US-10577355-B2 Hetero ring compound and organic luminescent element comprising same ORC3, CRY2, GLI1 KDM4E 1232/4885MAPT 1446/4885LMNA 3118/4885
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME DCX, TERT, TELO2 KDM4E 1392/4885MAPT 1276/4885LMNA 1895/4885
US-20130082209-A1 METAL COMPLEXES MCOLN2, MCOLN1, AP1M1 KDM4E 4129/4885MAPT 1164/4885LMNA 351/4885
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same CRY2, NR2E3, CRY1 KDM4E 1570/4885MAPT 530/4885LMNA 2374/4885

“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