SCHEMBL14919952

SCHEMBL14919952

CCOC(=O)C1=C(c2ccc(OC)cc2)CCN(C(=O)O)C1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 19/20 0.56
CHRM1 P11229 19/20 0.56
CHRM2 P08172 12/20 0.55
CHRM4 P08173 12/20 0.55
CHRM3 P20309 12/20 0.55
SLC6A3 Q01959 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
SCHEMBL14920560 0.85 CHRM5 (0.49) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL534910 0.81 CHRM5 (0.50) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL4049327 0.81 SLC6A3 (0.60) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL17474611 0.81 CHRM5 (0.68) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL20476229 0.80 ALDH1A1 (0.50) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL23039761 0.79 ALDH1A1 (0.46) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL18587017 0.78 SMN1; SMN2 (0.44) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL23040394 0.77 ALDH1A1 (0.47) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL21341963 0.77 ADORA1 (0.48) CHRM5CHRM1CHRM2CHRM4CHRM3
SCHEMBL20475211 0.76 CHRM5 (0.48) CHRM5CHRM1CHRM2CHRM4CHRM3

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
EP-2773637-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2014-09-10 EP disclosed
WO-2013064983-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2013-05-10 WO disclosed