SCHEMBL17692111

SCHEMBL17692111

c1ccc(-c2ccc3ccc4ccc5ccccc5c4c3c2)c(-c2ccc3sc4ccccc4c3c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.42
ALOX5 P09917 1/20 0.41
NQO2 P16083 2/20 0.39
NQO1 P15559 1/20 0.39
CYP1A2 P05177 1/20 0.38
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
S1PR4 O95977 4/20 0.35
S1PR5 Q9H228 4/20 0.35
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 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
SCHEMBL17692112 0.97 GPR3 (0.42) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692120 0.93 HPRT1 (0.39) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692093 0.90 NQO2 (0.40) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692104 0.90 ALOX5 (0.43) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692113 0.89 GPR3 (0.44) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692110 0.88 GPR3 (0.42) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL21283018 0.85 GPR3 (0.58) GPR3ALOX5CYP1A2MAPTALDH1A1
SCHEMBL17692118 0.84 NQO2 (0.40) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL17692088 0.84 NQO2 (0.41) GPR3ALOX5NQO2NQO1CYP1A2
SCHEMBL14101526 0.83 ALOX5 (0.41) GPR3ALOX5CYP1A2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10826000-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-11-03 US disclosed
US-20190036043-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-01-31 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed