SCHEMBL17443032

SCHEMBL17443032

Cc1cnc(C(=O)N[C@H]2CCCO[C@H]2O)cc1Cc1ccc(-n2cccn2)cc1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 19/20 0.82
▸ PDE2A O00408 1/20 0.46
▸ PDE11A Q9HCR9 1/20 0.46

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
SCHEMBL17440071 0.89 CHRM1 (0.98) CHRM1
SCHEMBL17439995 0.89 CHRM1 (0.98) CHRM1
SCHEMBL17439996 0.89 CHRM1 (0.98) CHRM1
SCHEMBL17439994 0.89 CHRM1 (0.98) CHRM1
SCHEMBL17440070 0.89 CHRM1 (0.98) CHRM1
SCHEMBL18756540 0.89 CHRM1 (0.98) CHRM1
SCHEMBL17440025 0.88 CHRM1 (1.00) CHRM1
SCHEMBL17440125 0.88 CHRM1 (1.00) CHRM1
SCHEMBL18725485 0.88 CHRM1 (1.00) CHRM1
SCHEMBL18725406 0.86 CHRM1 (0.89) CHRM1PDE2APDE11A

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-2016009297-A1 PYRIDINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS PFIZER INC. (US) 2016-01-21 — — WO disclosed
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