SCHEMBL9979045

SCHEMBL9979045

CCC1CCCC(NC(=O)c2cc(C(=O)NC3CCCC(CC)C3CC)cc(C(=O)NC3CCCC(CC)C3CC)c2)C1CC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 13/20 0.46
TAS1R1 Q7RTX1 12/20 0.46
TAS1R2 Q8TE23 12/20 0.46
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MLYCD O95822 1/20 0.36

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
SCHEMBL2454674 0.86 TAS1R3 (0.53) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL9979211 0.78 SMYD3 (0.38) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL2452339 0.77 TAS1R3 (0.50) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL2455117 0.75 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL2453088 0.73 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL5586122 0.73 SSTR3 (0.51) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL13990832 0.73 SSTR3 (0.51) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL9978823 0.73 SMYD3 (0.49) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL22462377 0.71 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL2454852 0.71 TAS1R3 (0.54) TAS1R3TAS1R1TAS1R2MEN1KMT2A

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