SCHEMBL14747225

SCHEMBL14747225

Cc1ccccc1Cn1cc(C(=O)O)c(=O)c2c(F)ccc(F)c21

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 6/20 0.66
MAPT P10636 3/20 0.42
RXFP1 Q9HBX9 2/20 0.41
HTT P42858 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NOD2 Q9HC29 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 2/20 0.39
MCL1 Q07820 1/20 0.39
BAD Q92934 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL14747226 0.86 CHRM1 (0.50) CHRM1MAPTRXFP1HTTLMNA
SCHEMBL2884792 0.84 CHRM1 (0.64) CHRM1LMNAALDH1A1
SCHEMBL2877481 0.84 CHRM1 (0.86) CHRM1MAPTHTTLMNA
SCHEMBL2880298 0.83 CHRM1 (0.62) CHRM1MAPTRAB9ALMNASMN1; SMN2
SCHEMBL2486081 0.81 CHRM1 (0.76) CHRM1MAPTHTTMCL1ALDH1A1
SCHEMBL2882158 0.80 CHRM1 (0.68) CHRM1HTTLMNAALDH1A1
SCHEMBL2486076 0.80 CHRM1 (1.00) CHRM1LMNA
SCHEMBL14307347 0.78 CHRM1 (0.58) CHRM1MAPTRXFP1HTTLMNA
SCHEMBL2486523 0.78 CHRM1 (0.58) CHRM1HTTALDH1A1
SCHEMBL2883197 0.78 CHRM1 (0.80) CHRM1LMNATP53SMN1; SMN2

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-8389545-B2 Quinolone M1 receptor positive allosteric modulators Merck, Sharp & Dohme, Corp. (US) 2013-03-05 US disclosed