SCHEMBL6891034

SCHEMBL6891034

Cn1cc(-c2ccc(Cc3cc(C(=O)NC4CCCCC4)nc4ccccc34)cn2)cn1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.65
AURKA O14965 2/20 0.48
AURKB Q96GD4 2/20 0.48
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43

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
SCHEMBL6889896 0.92 CHRM1 (0.78) CHRM1
SCHEMBL17656776 0.91 CHRM1 (0.65) CHRM1
SCHEMBL6888427 0.90 CHRM1 (0.74) CHRM1
SCHEMBL17656796 0.90 CHRM1 (0.63) CHRM1
SCHEMBL2224562 0.90 CHRM1 (0.63) CHRM1
SCHEMBL12802929 0.90 CHRM1 (0.74) CHRM1
SCHEMBL2222379 0.89 CHRM1 (0.64) CHRM1
SCHEMBL2277330 0.89 CHRM1 (0.64) CHRM1
SCHEMBL2221055 0.88 CHRM1 (0.55) CHRM1
SCHEMBL2364578 0.88 CHRM1 (0.61) CHRM1

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-2512243-B1 QUINOLINE AMIDE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2016-04-06 EP disclosed
WO-2011084368-A1 QUINOLINE AMIDE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed