SCHEMBL9979175

SCHEMBL9979175

CC(C)CC1CCC(NC(=O)c2cc(C(=O)NC3CCC(CC(C)C)CC3CC(C)C)cc(C(=O)NC3CCC(CC(C)C)CC3CC(C)C)c2)C(CC(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.38
TAS1R3 Q7RTX0 2/20 0.37
TAS1R1 Q7RTX1 2/20 0.37
TAS1R2 Q8TE23 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
SMYD3 Q9H7B4 3/20 0.36
GRN P28799 1/20 0.35
SORT1 Q99523 1/20 0.35
BRD4 O60885 1/20 0.33
TLR2 O60603 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM1A O60341 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL9979263 0.86 TAS1R3 (0.46) TRPV1TAS1R3TAS1R1TAS1R2TRPM8
SCHEMBL2453088 0.81 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL9978823 0.78 SMYD3 (0.49) TAS1R3TAS1R1TAS1R2SMYD3BRD4
SCHEMBL2452172 0.78 SMYD3 (0.44) SMYD3GRNSORT1BRD4KMT2A
SCHEMBL2450437 0.76 GRM5 (0.45) KMT2ACYP2D6CYP2C9
SCHEMBL22462372 0.76 TAS1R3 (0.44) TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL9979281 0.75 CYP2D6 (0.41) TAS1R3TAS1R1TAS1R2SMYD3TLR2
SCHEMBL22462415 0.72 SMYD3 (0.43) SMYD3BRD4KMT2ACYP2C9MAPK14
SCHEMBL22462397 0.71 CYP2D6 (0.43) KMT2ACYP2D6CYP2C9
SCHEMBL9979213 0.70 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2SMYD3

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