SCHEMBL4711784

SCHEMBL4711784

O=C(NN1CC2CCCC2C1)Oc1nn(-c2ccc(Cl)cc2Cl)c2c1CSC/C2=C\c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 0.45
CNR2 P34972 12/20 0.45

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
SCHEMBL4712170 0.90 CNR1 (0.47) CNR1CNR2
SCHEMBL4709571 0.90 CNR1 (0.47) CNR1CNR2
SCHEMBL4710825 0.90 CNR1 (0.47) CNR1CNR2
SCHEMBL4711767 0.90 CNR1 (0.40) CNR1CNR2
SCHEMBL3153456 0.89 CNR1 (0.54) CNR1CNR2
SCHEMBL4712334 0.88 CNR1 (0.46) CNR1CNR2
SCHEMBL1029851 0.88 CNR1 (0.45) CNR1CNR2
SCHEMBL4712909 0.88 CNR1 (0.46) CNR1CNR2
SCHEMBL13867166 0.87 CNR1 (0.57) CNR1CNR2
SCHEMBL1082469 0.86 CNR1 (0.46) 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-1863479-B1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS CROSS REFERENCE TO RELATED APPLICATIONS JANSSEN PHARMACEUTICA NV (BE) 2008-12-10 EP claimed