SCHEMBL300646

SCHEMBL300646

CC12CCC(C1)C(C)(C)C2NC(=O)c1nn(Cc2ccc(F)cc2)c2c1CCCCC2

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.56
CNR1 P21554 8/20 0.53

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
SCHEMBL14003099 0.91 CNR2 (0.60) CNR2CNR1
SCHEMBL10216961 0.91 CNR2 (0.52) CNR2CNR1
SCHEMBL13871505 0.91 CNR2 (0.52) CNR2CNR1
SCHEMBL13871490 0.86 CNR2 (0.57) CNR2CNR1
SCHEMBL2715683 0.86 CNR2 (0.57) CNR2CNR1
SCHEMBL300484 0.86 CNR2 (0.51) CNR2CNR1
SCHEMBL4879062 0.80 CNR2 (0.46) CNR2CNR1
SCHEMBL13871431 0.80 CNR2 (0.46) CNR2CNR1
SCHEMBL2714870 0.79 CNR2 (0.57) CNR2CNR1
SCHEMBL4881359 0.79 CNR2 (0.45) 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-1937259-B1 HEXAHYDRO-CYCLOHEPTAPYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-11-23 EP claimed