SCHEMBL31427

SCHEMBL31427

C=C(C)ON=C1CCC(NC(=O)N2CCn3c(Cl)c(-c4cccc(F)c4)c(C(N)=O)c3C2)CC1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 20/20 0.72

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
SCHEMBL30713310 0.93 CSNK1E (0.75) CSNK1E
SCHEMBL15891060 0.93 CSNK1E (0.75) CSNK1E
SCHEMBL14841543 0.90 CSNK1E (0.71) CSNK1E
SCHEMBL30713372 0.90 CSNK1E (0.71) CSNK1E
SCHEMBL14841656 0.84 CSNK1E (0.87) CSNK1E
SCHEMBL30713359 0.83 CSNK1E (1.00) CSNK1E
SCHEMBL15890845 0.83 CSNK1E (1.00) CSNK1E
SCHEMBL31219 0.83 CSNK1E (1.00) CSNK1E
SCHEMBL14841557 0.83 CSNK1E (1.00) CSNK1E
SCHEMBL30713315 0.83 CSNK1E (1.00) CSNK1E

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-2011161537-A2 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-29 WO disclosed