SCHEMBL17945271

SCHEMBL17945271

c1cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc(-c2c3sc4ccccc4c3cc3sc4ccccc4c23)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
ALOX5 P09917 1/20 0.36
PTPN1 P18031 2/20 0.36
MAPT P10636 3/20 0.35
GPR3 P46089 1/20 0.35
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
S1PR5 Q9H228 7/20 0.33
S1PR4 O95977 6/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 2/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NQO1 P15559 1/20 0.32
NQO2 P16083 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HPGD P15428 1/20 0.31

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
SCHEMBL17945683 0.95 HSD17B1 (0.35) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL17945714 0.95 PTPN1 (0.37) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL17945725 0.92 TNKS (0.40) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL17945011 0.92 PTPN1 (0.37) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL18268645 0.91 TNKS (0.39) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL19082310 0.91 NQO1 (0.34) ALOX5PTPN1MAPTHSD17B1HSD17B2
SCHEMBL17945101 0.89 ALOX5 (0.39) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL19082291 0.89 PTPN1 (0.35) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL17944636 0.88 ALOX5 (0.40) TNKSTNKS2ALOX5PTPN1MAPT
SCHEMBL17945053 0.88 TNKS (0.43) TNKSTNKS2ALOX5PTPN1MAPT

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
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed