SCHEMBL16768530

SCHEMBL16768530

c1ccc(-c2cccc(-c3sc(-c4cccc(-c5ccccc5)c4)c4c5ccncc5c5cnccc5c34)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.41
MAPK10 P53779 1/20 0.39
NOTUM Q6P988 1/20 0.38
MAP3K8 P41279 3/20 0.38
CSNK2A2 P19784 3/20 0.37
CSNK2B P67870 3/20 0.37
LOXL2 Q9Y4K0 1/20 0.37
CYP19A1 P11511 1/20 0.36
PRKCZ Q05513 1/20 0.35
PRKD2 Q9BZL6 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
NISCH Q9Y2I1 1/20 0.34
PIK3CA P42336 1/20 0.34
KDR P35968 1/20 0.34
ALOX5 P09917 1/20 0.34
KDM4C Q9H3R0 1/20 0.34

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
SCHEMBL16768526 0.89 NOTUM (0.42) TNFMAPK10NOTUMCSNK2A2CSNK2B
SCHEMBL16768527 0.89 TNF (0.43) TNFMAPK10NOTUMCSNK2A2CSNK2B
SCHEMBL16768519 0.80 CYP11B1 (0.49) TNFMAPK10CYP19A1PRKCZ
SCHEMBL16768535 0.79 CSNK2A2 (0.41) TNFMAPK10CSNK2A2CSNK2BCYP19A1
SCHEMBL16768536 0.78 TNF (0.41) TNFMAPK10CSNK2A2CSNK2BALOX5
SCHEMBL16768520 0.77 ALDH1A1 (0.41) CSNK2A2CSNK2BALOX5
SCHEMBL16768550 0.76 TNF (0.34) TNFMAPK10NOTUMCSNK2A2CSNK2B
SCHEMBL13021741 0.76 MAPK10 (0.45) TNFMAPK10NOTUMCSNK2A2CSNK2B
SCHEMBL13021754 0.76 MAPK10 (0.45) TNFMAPK10NOTUMCSNK2A2CSNK2B
SCHEMBL13021752 0.76 MAPK10 (0.45) TNFMAPK10NOTUMCSNK2A2CSNK2B

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-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed