SCHEMBL5314686

SCHEMBL5314686

COC(=O)N1CCc2c(c(C(=O)NC3C4(C)CCC(C4)C3(C)C)nn2Cc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.48
CNR1 P21554 5/20 0.48
IDH1 O75874 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
BRD4 O60885 1/20 0.39
EP300 Q09472 1/20 0.39
CREBBP Q92793 1/20 0.39
KCNK3 O14649 1/20 0.39

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
SCHEMBL5317181 0.94 CNR2 (0.45) CNR2CNR1IDH1TAS1R3TAS1R1
SCHEMBL5314891 0.93 CNR2 (0.44) CNR2CNR1IDH1TAS1R3TAS1R1
SCHEMBL5313239 0.93 CNR2 (0.44) CNR2CNR1IDH1TAS1R3TAS1R1
SCHEMBL5313689 0.87 CNR2 (0.48) CNR2CNR1TAS1R3TAS1R1
SCHEMBL10216961 0.85 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871505 0.85 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL5316984 0.85 CNR2 (0.46) CNR2CNR1TAS1R3TAS1R1
SCHEMBL4881359 0.83 CNR2 (0.45) CNR2CNR1TAS1R3TAS1R1
SCHEMBL5317196 0.83 CNR2 (0.45) CNR2CNR1TAS1R3TAS1R1
SCHEMBL4879062 0.82 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1804791-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-11 EP claimed
WO-2006049880-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-11 WO claimed
US-20060089378-A1 Tetrahydro-pyridinyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2006-04-27 US claimed
EP-1804791-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-11 EP disclosed
WO-2006049880-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-11 WO disclosed
US-20060089378-A1 Tetrahydro-pyridinyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2006-04-27 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 (1 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-20060089378-A1 Tetrahydro-pyridinyl pyrazole cannabinoid modulators CNR2, CNR1, GPR18 CNR2 1/4885CNR1 2/4885IDH1 3999/4885

“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.