SCHEMBL28918751

SCHEMBL28918751

CC(C)(C)NC(=O)O[C@@H]1CCN(c2ccnc(OCC(F)(F)F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACACB O00763 20/20 0.53

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
SCHEMBL28605983 0.86 ACACB (0.49) ACACB
SCHEMBL28605991 0.86 ACACB (0.49) ACACB
SCHEMBL28605616 0.83 ACACB (0.47) ACACB
SCHEMBL28918754 0.80 SYK (0.49) ACACB
SCHEMBL28918756 0.80 SYK (0.49) ACACB
SCHEMBL28597269 0.78 NOTUM (0.53) ACACB
SCHEMBL22499928 0.78 NOTUM (0.53) ACACB
SCHEMBL28603264 0.78 ACACB (0.48) ACACB
SCHEMBL22186757 0.78 HRH4 (0.50) ACACB
SCHEMBL28607375 0.77 ACACB (0.50) ACACB

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
CN-113164461-A Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2021-07-23 CN disclosed