SCHEMBL6889896

SCHEMBL6889896

Cn1cc(-c2ccc(Cc3cc(C(=O)NC4CCOCC4)nc4ccccc34)cn2)cn1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 9/20 0.78
BRD4 O60885 1/20 0.44

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
SCHEMBL6891034 0.92 CHRM1 (0.65) CHRM1
SCHEMBL17656776 0.91 CHRM1 (0.65) CHRM1
SCHEMBL6890837 0.90 CHRM1 (0.69) CHRM1BRD4
SCHEMBL21935670 0.89 CHRM1 (0.71) CHRM1
SCHEMBL2272428 0.88 CHRM1 (0.75) CHRM1
SCHEMBL12802594 0.88 CHRM1 (0.75) CHRM1
SCHEMBL2274204 0.88 CHRM1 (0.75) CHRM1
SCHEMBL31659430 0.87 CHRM1 (1.00) CHRM1
SCHEMBL23673059 0.87 CHRM1 (0.71) CHRM1
SCHEMBL23673040 0.87 CHRM1 (0.80) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011084368-A1 QUINOLINE AMIDE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed