SCHEMBL3408133

SCHEMBL3408133

CCn1cc(C(=O)N[C@H](C)C23CC4CC(CC(C4)C2)C3)c(=O)cc1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 1.00
CNR1 P21554 10/20 0.81
P2RX7 Q99572 1/20 0.53
THRB P10828 1/20 0.47

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
SCHEMBL3408129 1.00 CNR2 (1.00) CNR2CNR1P2RX7THRB
SCHEMBL3413432 0.90 CNR2 (1.00) CNR2CNR1
SCHEMBL3413436 0.90 CNR2 (1.00) CNR2CNR1
SCHEMBL3406882 0.86 CNR2 (0.75) CNR2CNR1P2RX7THRB
SCHEMBL3406886 0.86 CNR2 (0.75) CNR2CNR1P2RX7THRB
SCHEMBL9895909 0.76 CNR2 (1.00) CNR2CNR1
SCHEMBL9895230 0.74 CNR2 (1.00) CNR2CNR1
SCHEMBL3411192 0.74 CNR2 (1.00) CNR2CNR1
SCHEMBL843172 0.74 CNR2 (0.57) CNR2CNR1
SCHEMBL3412482 0.73 CNR2 (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2261211-A1 1,4-dihydropyridine derivatives and their uses Université de Lille 2 Droit et Santé (FR) 2010-12-15 EP disclosed