SCHEMBL2486150

SCHEMBL2486150

Cc1nc(-c2ccc(Cn3cc(OC(=O)O)c(=O)c4ccccc43)c(F)c2)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
CHRM1 P11229 4/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NOD2 Q9HC29 1/20 0.39
TP53 P04637 5/20 0.39
RXFP1 Q9HBX9 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL2486148 0.88 CHRM1 (0.52) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2487940 0.85 CHRM1 (0.44) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2492209 0.83 CHRM1 (0.44) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2485714 0.82 CHRM1 (0.45) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2489082 0.81 CHRM1 (0.45) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2488401 0.81 CHRM1 (0.62) CHRM1
SCHEMBL2490966 0.81 CHRM1 (0.42) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2487937 0.80 CHRM1 (0.42) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2488682 0.74 CHRM1 (0.57) MAPTCHRM1NPC1RAB9ANOD2
SCHEMBL2487939 0.72 LMNA (0.60) MAPTCHRM1NPC1RAB9ANOD2

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