SCHEMBL3145065

SCHEMBL3145065

C[C@H](NC(=O)Oc1nn(-c2ccc(Cl)cc2Cl)c2c1CCCCC/C2=C\c1ccc(F)cc1)C1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 19/20 0.60
CNR2 P34972 12/20 0.60

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
SCHEMBL3144246 1.00 CNR1 (0.60) CNR1CNR2
SCHEMBL300669 1.00 CNR1 (0.60) CNR1CNR2
SCHEMBL300684 1.00 CNR1 (0.60) CNR1CNR2
SCHEMBL300652 0.96 CNR1 (0.55) CNR1CNR2
SCHEMBL300547 0.96 CNR1 (0.55) CNR1CNR2
SCHEMBL300752 0.92 CNR1 (0.51) CNR1CNR2
SCHEMBL300719 0.90 CNR1 (0.49) CNR1CNR2
SCHEMBL300493 0.90 CNR1 (0.49) CNR1CNR2
SCHEMBL1031734 0.90 CNR1 (0.50) CNR1CNR2
SCHEMBL300391 0.89 CNR1 (0.51) CNR1CNR2

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-1931335-B1 HEXAHYDRO CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-02-24 EP claimed