SCHEMBL19932682

SCHEMBL19932682

Cn1cc(-c2ccc(Cc3cc(C(=O)NC4CCCCC4)nc4c3OCCO4)cc2)cn1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 7/20 0.57
▸ CCNC P24863 2/20 0.47
▸ CDK8 P49336 2/20 0.47
▸ AURKA O14965 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ CNR1 P21554 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ PIK3CD O00329 1/20 0.39

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
SCHEMBL22212626 0.89 CHRM1 (0.44) CHRM1PIK3CD
SCHEMBL19932681 0.89 CHRM1 (0.64) CHRM1
SCHEMBL19932680 0.88 CHRM1 (0.54) CHRM1CCNCCDK8AURKAAURKB
SCHEMBL19932608 0.84 CHRM1 (0.45) CHRM1CCNCCDK8
SCHEMBL19932610 0.83 CHRM1 (0.46) CHRM1CCNCCDK8
SCHEMBL22212621 0.83 NPC1 (0.48) CNR1CNR2
SCHEMBL21935357 0.82 CHRM1 (0.64) CHRM1CCNCCDK8
SCHEMBL22212650 0.82 NPC1 (0.49) CNR1CNR2
SCHEMBL19932652 0.81 CHRM1 (0.42) CHRM1CNR1CNR2
SCHEMBL22212639 0.80 CHRM1 (0.69) CHRM1CCNCCDK8

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-3507289-B1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2020-07-15 — — EP disclosed
WO-2018042362-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2018-03-08 — — WO disclosed
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