SCHEMBL17692121

SCHEMBL17692121

c1ccc2c(c1)ccc1c2ccc2c(-c3ccc4sc5ccccc5c4c3)cc3ccccc3c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.39
NQO1 P15559 1/20 0.39
HPRT1 P00492 3/20 0.38
GPR3 P46089 1/20 0.38
ALDH1A1 P00352 6/20 0.37
HSD17B10 Q99714 4/20 0.37
HPGD P15428 3/20 0.37
CYP1A2 P05177 3/20 0.37
HIF1A Q16665 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TSHR P16473 2/20 0.37
MAOA P21397 2/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL17692088 0.96 NQO2 (0.41) NQO2NQO1HPRT1GPR3ALDH1A1
SCHEMBL17692118 0.90 NQO2 (0.40) NQO2NQO1HPRT1GPR3ALDH1A1
SCHEMBL17692100 0.89 NQO2 (0.39) NQO2NQO1HPRT1GPR3ALDH1A1
SCHEMBL17692120 0.85 HPRT1 (0.39) NQO2NQO1HPRT1GPR3ALDH1A1
SCHEMBL20698267 0.84 NQO1 (0.32) NQO2NQO1
SCHEMBL18907601 0.84 GPR3 (0.44) GPR3ALDH1A1HSD17B10HPGDCYP1A2
SCHEMBL14101680 0.84 CYP1A2 (0.47) HPRT1ALDH1A1HSD17B10HPGDCYP1A2
SCHEMBL16303040 0.83 CYP11B1 (0.43) GPR3ALDH1A1HSD17B10HPGDCYP1A2
SCHEMBL24362889 0.83 HPRT1 (0.37) NQO2NQO1HPRT1GPR3ALDH1A1
SCHEMBL24362819 0.83 HPRT1 (0.37) NQO2NQO1HPRT1ALDH1A1HSD17B10

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