SCHEMBL9979213

SCHEMBL9979213

CCC1CCC(NC(=O)c2cc(C(=O)NC3CCC(CC)CC3C)cc(C(=O)NC3CCC(CC)CC3C)c2)C(C)C1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 15/20 0.49
TAS1R1 Q7RTX1 14/20 0.49
TAS1R2 Q8TE23 14/20 0.49
CRHR1 P34998 1/20 0.40
MLYCD O95822 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38

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
SCHEMBL9978902 0.90 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2CRHR1MLYCD
SCHEMBL9978823 0.85 SMYD3 (0.49) TAS1R3TAS1R1TAS1R2SMYD3
SCHEMBL9979263 0.84 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2CRHR1MLYCD
SCHEMBL9979046 0.81 TAS1R3 (0.54) TAS1R3TAS1R1TAS1R2MLYCD
SCHEMBL22580633 0.78 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2CRHR1
SCHEMBL9979374 0.76 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2MLYCD
SCHEMBL9979162 0.76 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2MLYCD
SCHEMBL2454233 0.76 SMYD3 (0.48) SMYD3
SCHEMBL25863591 0.74 NPC1 (0.53) TAS1R3TAS1R1TAS1R2
SCHEMBL2452863 0.74 GRM5 (0.48) CA12CA9

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