SCHEMBL23387378

SCHEMBL23387378

O=C(O)NC1CCN(c2ccc(F)c(C(F)(F)F)c2)C1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 12/20 0.68
▸ ACACB O00763 2/20 0.50
▸ CCNC P24863 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ TAS1R3 Q7RTX0 1/20 0.44
▸ TAS1R1 Q7RTX1 1/20 0.44
▸ TAS1R2 Q8TE23 1/20 0.44
▸ USP30 Q70CQ3 1/20 0.42
▸ AR P10275 2/20 0.42

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
SCHEMBL23387375 1.00 NOTUM (0.68) NOTUMACACBCCNCCDK8TAS1R3
SCHEMBL22499837 0.84 NOTUM (0.57) NOTUMACACB
SCHEMBL21625629 0.82 NOTUM (0.55) NOTUMACACB
SCHEMBL21625630 0.82 NOTUM (0.55) NOTUMACACB
SCHEMBL3931285 0.81 USP30 (0.49) NOTUMUSP30
SCHEMBL3931291 0.81 USP30 (0.49) NOTUMUSP30
SCHEMBL21624686 0.81 NOTUM (0.53) NOTUMACACBCCNCCDK8
SCHEMBL21624688 0.81 NOTUM (0.53) NOTUMACACBCCNCCDK8
SCHEMBL23387314 0.81 NOTUM (0.64) NOTUMUSP30
SCHEMBL23387267 0.81 NOTUM (0.64) NOTUMUSP30

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
EP-3825303-A1 T-TYPE CALCIUM CHANNEL BLOCKER Nippon Chemiphar Co., Ltd. (JP) 2021-05-26 — — EP disclosed
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