SCHEMBL10693309

SCHEMBL10693309

COc1ccc(CCN(C(=O)CO)c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.58
CHRM5 P08912 4/20 0.58
CHRM1 P11229 4/20 0.58
CHRM3 P20309 4/20 0.58
CHRM2 P08172 1/20 0.54
CHRM4 P08173 1/20 0.54
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TRPM8 Q7Z2W7 2/20 0.48
RNF4 P78317 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
OPRM1 P35372 2/20 0.47
LPAR1 Q92633 1/20 0.47
LPAR5 Q9H1C0 1/20 0.47
KCNH2 Q12809 1/20 0.47
ATM Q13315 1/20 0.46
TAS2R14 Q9NYV8 1/20 0.46

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
SCHEMBL11225170 0.86 CHRM5 (0.60) ALOX5CHRM5CHRM1CHRM3CHRM2
SCHEMBL10693233 0.86 RNF4 (0.64) CHRM1CHRM3CHRM2MEN1KMT2A
SCHEMBL10695487 0.85 NPC1 (0.50) ALOX5CHRM1CHRM3CHRM2MEN1
SCHEMBL10694993 0.84 CHRM5 (0.54) ALOX5CHRM5CHRM1CHRM3CHRM2
SCHEMBL10694223 0.83 CHRM5 (0.60) CHRM5CHRM1CHRM3CHRM2NPC1
SCHEMBL4560242 0.81 NPC1 (0.60) ALOX5CHRM5CHRM1CHRM3NPC1
SCHEMBL22109186 0.78 ALOX5 (0.50) ALOX5CHRM5CHRM1CHRM3CHRM2
SCHEMBL6533560 0.77 CHRM5 (0.53) ALOX5CHRM5CHRM1CHRM3CHRM2
SCHEMBL4140615 0.77 ALOX5 (0.60) ALOX5CHRM5CHRM1CHRM3RNF4
SCHEMBL6320202 0.76 OPRM1 (0.62) ALOX5CHRM5CHRM1CHRM3OPRM1

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-0254866-A1 Quinolin derivatives, method for their preparation, microbizides containing them and their use in combating bacteria and fungi BASF Aktiengesellschaft (DE) 1988-02-03 EP disclosed