SCHEMBL13624400

SCHEMBL13624400

CCN1CCC(CC=O)CC1=O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.32
ALOX15 P16050 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL13624405 0.78 POLB (0.40) BRD4
SCHEMBL21484158 0.76 PRKCB (0.34) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL21106863 0.76 PIK3CD (0.39) PIK3CDALOX15CHRM2CHRM4CHRM5
SCHEMBL1272035 0.75 HSD17B10 (0.33) ALOX15
SCHEMBL13624406 0.74 GAA (0.38) BRD4
SCHEMBL1272034 0.73 USP19 (0.32)
SCHEMBL13624403 0.73 POLB (0.40) ALOX15BRD4
SCHEMBL15228275 0.72 CHRM2 (0.45) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL13624402 0.72 F10 (0.35)
SCHEMBL14275836 0.71 CHRM2 (0.33) PIK3CDCHRM2CHRM4CHRM5CHRM1

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
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed