SCHEMBL16610090

SCHEMBL16610090

Cc1ccc(F)c2c(C(=O)NC3CCCCC3)cn(Cc3ccc(-c4cnn(C)c4)cc3F)c12

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 16/20 0.54
USP30 Q70CQ3 2/20 0.46
CHRM5 P08912 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL16597526 0.92 CHRM1 (0.54) CHRM1USP30CHRM5
SCHEMBL17924348 0.90 CHRM1 (0.68) CHRM1
SCHEMBL16610091 0.89 CNR1 (0.49) CHRM1USP30
SCHEMBL16597412 0.86 CHRM1 (0.56) CHRM1USP30CHRM5
SCHEMBL16610132 0.86 CHRM1 (0.67) CHRM1
SCHEMBL17929750 0.84 CHRM1 (0.71) CHRM1
SCHEMBL16597405 0.82 CHRM1 (0.52) CHRM1USP30
SCHEMBL16597400 0.81 CHRM1 (0.49) CHRM1USP30
SCHEMBL16597442 0.80 CHRM1 (0.48) CHRM1USP30
SCHEMBL17924278 0.80 CHRM1 (0.65) 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-2015044072-A1 INDOL AND INDAZOL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-04-02 WO disclosed