SCHEMBL9717454

SCHEMBL9717454

CCCCCCC/C=C(\C)C(=O)NC(CC)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.39
EP300 Q09472 1/20 0.36
FAAH O00519 3/20 0.33
TP53 P04637 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
ASAH1 Q13510 1/20 0.31
PLA2G2C Q5R387 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ASAH2 Q9NR71 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SLC6A5 Q9Y345 1/20 0.30

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
SCHEMBL14691623 0.73 EP300 (0.44) CCR2EP300FAAHTP53CYP1A2
SCHEMBL9717462 0.73 CCR2 (0.40) CCR2EP300FAAH
Semiplenamide C SCHEMBL16431738 0.71 CNR2 (0.50) CCR2EP300TP53CYP1A2CYP2D6
Semiplenamide E SCHEMBL16432052 0.69 PRKCA (0.42) CCR2EP300FAAHMAPTZDHHC7
Semiplenamide D SCHEMBL3199261 0.69 PRKCA (0.42) CCR2EP300FAAHMAPTZDHHC7
SCHEMBL7676996 0.69 EP300 (0.50) CCR2EP300FAAHCYP1A2MAPT
SCHEMBL647032 0.68 EP300 (0.48) CCR2EP300FAAHCYP1A2MAPT
SCHEMBL28271939 0.68 FAAH (0.43) CCR2EP300FAAHMAPK1ALDH1A1
SCHEMBL9425050 0.67 EP300 (0.52) CCR2EP300FAAHCYP1A2MAPT
SCHEMBL27729661 0.67 EP300 (0.43) CCR2EP300FAAHCYP1A2MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5162391-A Copolymer of Siloxanyalkylacrylamide of a Fluoro Monomer KURARAY CO., LTD. (JP) 1992-11-10 US disclosed