SCHEMBL10080609

SCHEMBL10080609

CC12CCC(C1)C(C)(C)C2NC(=O)c1nn(C2CCCC2)c2c1CCCCCC2

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.52
CNR1 P21554 11/20 0.46
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43

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
SCHEMBL300343 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL14003059 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871323 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871348 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL300396 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL3773738 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871487 1.00 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL10080610 0.98 CNR2 (0.50) CNR2CNR1TAS1R3TAS1R1
SCHEMBL2716866 0.89 CNR2 (0.44) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871366 0.89 CNR2 (0.46) CNR2CNR1TAS1R3TAS1R1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101592-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA N.V. (BG) 2012-01-24 US disclosed
US-20100317633-A1 HEXAHYDRO-CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-16 US disclosed
US-20100317633-A1 HEXAHYDRO-CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-16 US disclosed
US-7851498-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2010-12-14 US disclosed
US-7851498-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2010-12-14 US disclosed
US-7825151-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2010-11-02 US disclosed
US-7825151-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2010-11-02 US disclosed
US-20100234331-A1 HEXAHYDRO-CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-16 US disclosed
US-20080076814-A1 Hexahydro-Cyclooctyl Pyrazole Cannabinoid Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-27 US disclosed
US-20080076814-A1 Hexahydro-Cyclooctyl Pyrazole Cannabinoid Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-27 US disclosed
US-20070129417-A1 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-07 US disclosed
US-20070129417-A1 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100317633-A1 HEXAHYDRO-CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, FAAH CNR2 2/4885CNR1 1/4885TAS1R3 1605/4885
US-20070129417-A1 Hexahydro-cyclooctyl pyrazole cannabinoid modulators CNR1, CNR2, FAAH CNR2 2/4885CNR1 1/4885TAS1R3 1605/4885
US-20100234331-A1 HEXAHYDRO-CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, FAAH CNR2 2/4885CNR1 1/4885TAS1R3 1605/4885
US-20080076814-A1 Hexahydro-Cyclooctyl Pyrazole Cannabinoid Modulators CNR1, CNR2, FAAH CNR2 2/4885CNR1 1/4885TAS1R3 1605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.