SCHEMBL28046238

SCHEMBL28046238

COc1cc(=O)n(C)c2c(C3=CC=CC=CN3)c(N(C)C)ccc12.Cc1cc(=O)[nH]c2cc(N(C)C)ccc12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TNKS2 Q9H2K2 5/20 0.37
AR P10275 2/20 0.34
NQO2 P16083 7/20 0.33
CYP19A1 P11511 6/20 0.33
MAPT P10636 2/20 0.31
THRB P10828 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL28428097 0.72 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL74712 0.68 AR (0.65) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL29379051 0.68 AR (0.65) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL28067946 0.58 CA12 (0.53) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL1394900 0.57 AR (0.58) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL2268508 0.56 AR (0.61) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL394584 0.56 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL30634405 0.56 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL19146396 0.55 NQO2 (0.60) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL9922457 0.55 ADORA3 (0.56) KDM4EALDH1A1HPGDHSD17B10GLA

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
CN-105392684-A Interior train components having low smoke and low heat release, and methods of their manufacture SABIC INNOVATIVE PLASTICS IP 2016-03-09 CN disclosed
CN-105209312-A Interior train components having low smoke and low heat release, and methods of their manufacture SABIC INNOVATIVE PLASTICS IP 2015-12-30 CN disclosed
CN-101268513-B Authenticable plastic material, articles, and methods for their fabrication GEN ELECTRIC 2010-05-19 CN disclosed
CN-101268513-A Authenticatable plastic material, articles, and methods for their fabrication GEN ELECTRIC (US) 2008-09-17 CN disclosed