SCHEMBL16004285

SCHEMBL16004285

CNC(=O)N1CCOc2ccc(CN(C)C(C)=O)cc2C1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 20/20 0.54

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
SCHEMBL16004283 0.90 CREBBP (0.52) CREBBP
SCHEMBL16004269 0.89 RIPK1 (0.46) CREBBP
SCHEMBL16004249 0.87 RIPK1 (0.41) CREBBP
SCHEMBL16004278 0.86 GPR142 (0.59)
SCHEMBL16004070 0.86 GPR142 (0.49) CREBBP
SCHEMBL16004068 0.86 MAPT (0.49) CREBBP
SCHEMBL16004274 0.85 RIPK1 (0.46) CREBBP
SCHEMBL16004073 0.85 GPR142 (0.60)
SCHEMBL16003958 0.85 CREBBP (0.56) CREBBP
SCHEMBL16004071 0.85 GPR142 (0.60)

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-2014133414-A2 HETEROCYCLIC TGR5 BILE ACID RECEPTOR AGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR THE PRODUCTION AND USE THEREOF АЛЛА ХЕМ ЛЛС (US) 2014-09-04 WO disclosed