SCHEMBL843701

SCHEMBL843701

Cc1cc(=O)c(C(N)=O)cn1CC1CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.63
CNR1 P21554 14/20 0.47
BRD4 O60885 1/20 0.44

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
SCHEMBL843936 0.88 CNR2 (0.64) CNR2CNR1BRD4
SCHEMBL843916 0.88 CNR2 (0.64) CNR2CNR1BRD4
SCHEMBL859363 0.79 CNR2 (0.71) CNR2CNR1BRD4
SCHEMBL28346478 0.79 CNR2 (0.43) CNR2CNR1BRD4
SCHEMBL859362 0.78 CNR2 (1.00) CNR2CNR1
SCHEMBL843288 0.76 CNR2 (0.66) CNR2CNR1BRD4
SCHEMBL29814512 0.75 CNR2 (0.43) CNR2CNR1BRD4
SCHEMBL28343429 0.73 CNR2 (0.48) CNR2CNR1BRD4
SCHEMBL3186811 0.72 CNR2 (0.74) CNR2CNR1
SCHEMBL3169285 0.72 CNR1 (0.60) CNR2CNR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432763-A1 1,4 DIHYDROPYRIDINE DERIVATIVES AND THEIR USES Université de Lille 2 Droit et Santé (FR) 2012-03-28 EP claimed
WO-2010133973-A1 1,4 DIHYDROPYRIDINE DERIVATIVES AND THEIR USES UNIVERSITE LILLE 2 DROIT ET SANTE (FR) 2010-11-25 WO claimed