SCHEMBL8994883

SCHEMBL8994883

c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cc5c6ccccc6ccc5c5ccccc45)s3)s2)c2cc3c4ccccc4ccc3c3ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 5/20 0.39
CYP1B1 Q16678 2/20 0.34
CYP1A1 P04798 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP2A6 P11509 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HIF1A Q16665 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PAX8 Q06710 1/20 0.31
APP P05067 1/20 0.31
SOS1 Q07889 1/20 0.30

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
SCHEMBL8994833 0.90 TRPM4 (0.33) HPRT1CYP1B1ALDH1A1HSD17B10HIF1A
SCHEMBL9888987 0.83 HPRT1 (0.52) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL8994816 0.81 SIGMAR1 (0.41) CYP1B1CYP1A1ALDH1A1HSD17B10CYP2A6
SCHEMBL4545234 0.81 HPRT1 (0.48) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL9971943 0.79 HPRT1 (0.47) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL14070252 0.79 CYP1B1 (0.36) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL9971924 0.78 HPRT1 (0.45) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL9971925 0.78 HPRT1 (0.45) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL12175919 0.78 HPRT1 (0.45) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10
SCHEMBL4545235 0.77 HPRT1 (0.44) HPRT1CYP1B1CYP1A1ALDH1A1HSD17B10

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-8187728-B2 Organic electroluminescent device and display device SONY CORPORATION (JP) 2012-05-29 US disclosed
US-8187728-B2 Organic electroluminescent device and display device SONY CORPORATION (JP) 2012-05-29 US disclosed
US-20090026935-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY DEVICE SONY CORPORATION (JP) 2009-01-29 US disclosed
US-20090026935-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY DEVICE SONY CORPORATION (JP) 2009-01-29 US disclosed