SCHEMBL3470181

SCHEMBL3470181

CCOC(=O)C1C2C=CC(C2)C1NC(=O)c1nn(C2CCCCC2)c2c1CCCCC2Cc1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.32

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
SCHEMBL176896 1.00 CNR2 (0.33) CNR2CNR1
SCHEMBL3470473 1.00 CNR2 (0.33) CNR2CNR1
SCHEMBL176605 0.92 NR1H4 (0.32) CNR2CNR1
SCHEMBL3469214 0.92 NR1H4 (0.32) CNR2CNR1
SCHEMBL3469281 0.92 NR1H4 (0.32) CNR2CNR1
SCHEMBL176705 0.90 RORC (0.38) CNR2
SCHEMBL4909168 0.89 CNR2 (0.35) CNR2CNR1
SCHEMBL4917829 0.85 CNR2 (0.33) CNR2
SCHEMBL13871564 0.83 CNR2 (0.48) CNR2CNR1
SCHEMBL13871563 0.83 CNR2 (0.48) 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-2139328-A2 HEXAHYDRO-CYCLOHEPTAPYRAZOLE CANNABINOID MODULATORS Janssen Pharmaceutica, N.V. (BE) 2010-01-06 EP disclosed
WO-2008115705-A2 HEXAHYDRO-CYCLOHEPTAPYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-25 WO disclosed