SCHEMBL11213974

SCHEMBL11213974

c1ccc2c(c1)-c1cccc3cncc-2c13

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
MAPK1 P28482 5/20 0.61
HSD17B10 Q99714 5/20 0.61
TSHR P16473 3/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
ATM Q13315 2/20 0.61
CASP1 P29466 3/20 0.48
CASP7 P55210 2/20 0.48
CYP3A4 P08684 1/20 0.48
PABPC1 P11940 1/20 0.48
DNMT1 P26358 1/20 0.48
HPGD P15428 4/20 0.48
HIF1A Q16665 2/20 0.48
TP53 P04637 1/20 0.48
PRKCZ Q05513 1/20 0.40
CES2 O00748 1/20 0.39
BCHE P06276 1/20 0.39
CES1 P23141 1/20 0.39
MCL1 Q07820 1/20 0.39
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL17228826 0.88 ALDH1A1 (0.46) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
Fluoranthene SCHEMBL29396242 0.77 ALDH1A1 (1.00) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
Fluoranthene SCHEMBL27152 0.77 ALDH1A1 (1.00) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
Fluoranthene SCHEMBL29355720 0.77 ALDH1A1 (1.00) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
Fluoranthene SCHEMBL8873541 0.77 ALDH1A1 (1.00) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL23525587 0.77 ALDH1A1 (1.00) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL13959699 0.77 KDM4E (0.46) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL3672396 0.77 MAPK1 (0.67) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL18892614 0.76 ALDH1A1 (0.37) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL6852783 0.76 ALDH1A1 (0.58) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed
US-4329254-A CHROMATOGRAPHY CHMIELOWIEC JAN 1982-05-11 US disclosed