SCHEMBL19268090

SCHEMBL19268090

CNc1c(Cc2ccc(-c3cscn3)cc2)cc(C(=O)NC2CC3(COC3)C2)nc1C=N

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 10/20 0.48
▸ PDE2A O00408 1/20 0.48
▸ PDE11A Q9HCR9 1/20 0.48
▸ GABRA1 P14867 5/20 0.34

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
SCHEMBL19268068 0.81 CHRM1 (0.44) CHRM1PDE2APDE11A
SCHEMBL23672881 0.81 CHRM1 (0.46) CHRM1PDE2APDE11AGABRA1
SCHEMBL23672612 0.80 CHRM1 (0.49) CHRM1PDE2APDE11A
SCHEMBL19268069 0.80 CHRM1 (0.47) CHRM1PDE2APDE11A
SCHEMBL20031032 0.76 CHRM1 (0.53) CHRM1PDE2APDE11A
SCHEMBL20030497 0.70 CHRM1 (0.77) CHRM1PDE2APDE11A
SCHEMBL23672853 0.70 CHRM1 (0.40) CHRM1PDE2APDE11A
SCHEMBL23672892 0.70 CHRM1 (0.35) CHRM1PDE2APDE11AGABRA1
SCHEMBL23672863 0.69 CHRM1 (0.51) CHRM1PDE2APDE11A
SCHEMBL23672596 0.69 CHRM1 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416639-B1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 UNIV VANDERBILT (US) 2022-06-08 — — EP disclosed
WO-2017143041-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 VANDERBILT UNIVERSITY (US) 2017-08-24 — — WO disclosed
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