SCHEMBL17692104

SCHEMBL17692104

c1ccc2c(c1)ccc1ccc3cccc(-c4ccc5sc6ccccc6c5c4)c3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
GPR3 P46089 1/20 0.41
ALDH1A1 P00352 4/20 0.39
CYP1A2 P05177 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 2/20 0.39
THRB P10828 1/20 0.39
NQO1 P15559 1/20 0.38
NQO2 P16083 1/20 0.38
S1PR5 Q9H228 7/20 0.37
S1PR4 O95977 6/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.37
MAPT P10636 3/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MCL1 Q07820 1/20 0.35

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 0.93 GPR3 (0.42) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL17692111 0.90 GPR3 (0.42) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL14101526 0.87 ALOX5 (0.41) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL14101525 0.87 F9 (0.41) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL17692118 0.86 NQO2 (0.40) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL14101522 0.85 CYP1A2 (0.44) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL18820492 0.85 ALDH1A1 (0.41) ALOX5ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL25858364 0.84 ALOX5 (0.43) ALOX5GPR3ALDH1A1CYP1A2HPGD
SCHEMBL14101523 0.84 CYP1A2 (0.42) ALOX5ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL14101438 0.84 MCL1 (0.40) ALOX5ALDH1A1CYP1A2HPGDHSD17B10

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