SCHEMBL9978978

SCHEMBL9978978

CCCCc1cccc(NC(=O)c2cc(C(=O)Nc3cccc(CCCC)c3)cc(C(=O)Nc3cccc(CCCC)c3)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.62
THRB P10828 1/20 0.57
PLK1 P53350 1/20 0.53
S1PR1 P21453 4/20 0.52
S1PR4 O95977 2/20 0.52
S1PR3 Q99500 2/20 0.52
S1PR5 Q9H228 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.51
NR1H4 Q96RI1 2/20 0.50
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
PPARA Q07869 1/20 0.50

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
SCHEMBL9979424 0.91 ABCG2 (0.54) TRPV1THRBMEN1KMT2AALDH1A1
SCHEMBL13065985 0.88 S1PR1 (0.59) TRPV1THRBPLK1S1PR1S1PR4
SCHEMBL25938725 0.87 TRPV1 (0.66) TRPV1PLK1S1PR1S1PR4S1PR3
SCHEMBL30605278 0.87 TRPV1 (0.66) TRPV1PLK1S1PR1S1PR4S1PR3
SCHEMBL5074115 0.84 RAB9A (0.57) TRPV1S1PR1S1PR4S1PR3S1PR5
SCHEMBL9979193 0.84 ALDH1A1 (0.62) THRBMEN1KMT2AALDH1A1NR1H4
SCHEMBL3023471 0.84 POLB (0.56) TRPV1S1PR1S1PR4S1PR3S1PR5
SCHEMBL6836848 0.83 S1PR1 (0.53) TRPV1S1PR1S1PR4S1PR3S1PR5
SCHEMBL2915657 0.83 TRPV1 (0.72) TRPV1PLK1ALDH1A1
SCHEMBL13168926 0.82 NPC1 (0.50) TRPV1MEN1KMT2ANR1H4

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-8492468-B2 Polypropylene resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-23 US disclosed
US-20110301268-A1 POLYPROPYLENE RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-08 US disclosed