SCHEMBL697051

SCHEMBL697051

Cc1cccc(C(C)c2nccn2CCOC(=O)N(C)CCS(C)(=O)=O)c1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
FPR2 P25090 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
TP53 P04637 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
SCHEMBL697050 0.82 TP53 (0.31) TP53
SCHEMBL697894 0.76 TDP1 (0.37) MAPT
SCHEMBL695952 0.74 CHRNB2 (0.43) SMN1; SMN2ALDH1A1
SCHEMBL696322 0.73 ALDH1A1 (0.38) SMN1; SMN2FPR2ALDH1A1MAPTTP53
SCHEMBL696323 0.72 SMN1; SMN2 (0.38) SMN1; SMN2FPR2ALDH1A1MAPTTP53
SCHEMBL696999 0.72 ALDH1A1 (0.37) SMN1; SMN2FPR2ALDH1A1MAPTTP53
SCHEMBL4008283 0.72 FFAR1 (0.39) SMN1; SMN2MAPTTP53
SCHEMBL4014276 0.71 SMN1; SMN2 (0.51) SMN1; SMN2FPR2ALDH1A1TP53
SCHEMBL4007502 0.70 SMN1; SMN2 (0.50) SMN1; SMN2FPR2ALDH1A1
SCHEMBL696897 0.70 ALDH1A1 (0.38) SMN1; SMN2FPR2ALDH1A1MAPTTP53

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
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed