SCHEMBL20018993

SCHEMBL20018993

CC1CC=Cc2c1oc1cc(N)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 2/20 0.39
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ OPRM1 P35372 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ RAD52 P43351 1/20 0.34
▸ SRC P12931 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NPSR1 Q6W5P4 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
SCHEMBL22084924 0.88 KMT2A (0.42) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL21019289 0.80 TAAR1 (0.45) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL21776085 0.78 KDM4E (0.42) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL22562233 0.75 KDM4E (0.38) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL20860970 0.75 TSHR (0.35) KDM4EALDH1A1HPGDKMT2AMAPT
SCHEMBL22524162 0.74 LMNA (0.39) ALDH1A1MEN1KMT2AGAASRC
SCHEMBL22147062 0.73 PIM1 (0.36) ALDH1A1HPGDKMT2AMAPTCA12
SCHEMBL22423590 0.71 ALDH1A1 (0.31) ALDH1A1HPGDHSD17B10
SCHEMBL21765370 0.69 KMT2A (0.44) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL17773929 0.68 CYP1A1 (0.35) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613752-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2021-12-22 — — EP disclosed
EP-3301097-A2 [1]BENZOTHIENO[3',2':4,5]IMIDAZO[1,2-A]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN ORGANIC LIGHT-EMITTING DEVICES (OLEDS) Samsung Display Co., Ltd. (KR) 2018-04-04 — — EP disclosed
Send feedback