SCHEMBL2490480

SCHEMBL2490480

Cn1cc(-c2ccc(Cn3cc(OC(=O)O)c(=O)c4c(F)cccc43)c(F)c2)cn1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 20/20 0.76
CHRM5 P08912 1/20 0.47

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
SCHEMBL2489080 0.90 CHRM1 (0.62) CHRM1CHRM5
SCHEMBL2488401 0.89 CHRM1 (0.62) CHRM1CHRM5
SCHEMBL2484371 0.88 CHRM1 (0.59) CHRM1CHRM5
SCHEMBL2490478 0.86 CHRM1 (1.00) CHRM1CHRM5
SCHEMBL2487495 0.85 CHRM1 (0.55) CHRM1
SCHEMBL16597420 0.83 CHRM1 (0.88) CHRM1CHRM5
SCHEMBL16597386 0.83 CHRM1 (0.74) CHRM1CHRM5
SCHEMBL16597646 0.81 CHRM1 (0.74) CHRM1CHRM5
SCHEMBL19134382 0.81 CHRM1 (0.77) CHRM1CHRM5
SCHEMBL16597436 0.81 CHRM1 (0.77) CHRM1CHRM5

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-2037739-B1 BENZYL-SUBSTITUTED QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2011-10-26 EP claimed