SCHEMBL4928211

SCHEMBL4928211

COc1ccc(-n2nc3c(c2-c2ccc(C)cc2)CCCC3C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
CFTR P13569 1/20 0.41
CCKAR P32238 7/20 0.41
SIRT1 Q96EB6 1/20 0.41
PTGS2 P35354 2/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
CCNA1 P78396 1/20 0.40
PTGS1 P23219 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
RPA1 P27694 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 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
SCHEMBL3085780 0.84 CNR1 (0.37) CNR1CNR2CFTRCCKARCCNA2
SCHEMBL3088156 0.84 CNR1 (0.37) CNR1CNR2CFTRCCKARCCNA2
SCHEMBL13145271 0.81 CNR1 (0.38) CNR1CNR2CFTRCCKARMAPT
SCHEMBL3086840 0.81 CNR1 (0.38) CNR1CNR2CFTRCCKARMAPT
SCHEMBL13180103 0.80 CCKAR (0.36) CNR1CNR2CCKAR
SCHEMBL3085611 0.80 CNR1 (0.55) CNR1CNR2CCKAR
SCHEMBL3069919 0.80 CNR1 (0.55) CNR1CNR2CCKAR
SCHEMBL3075301 0.80 CNR1 (0.55) CNR1CNR2CCKAR
SCHEMBL3094082 0.79 CNR2 (0.43) CNR1CNR2
SCHEMBL3088729 0.78 FAAH (0.37) CNR1CNR2CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058313-A1 TETRAHYDRO-2H-INDAZOLE PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-03-06 US claimed
WO-2007095513-A1 TETRAHYDR0-2H-INDAZ0LE DERIVATIVES FOR USE AS CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, NV (BE) 2007-08-23 WO claimed
US-20080058313-A1 TETRAHYDRO-2H-INDAZOLE PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-03-06 US disclosed
WO-2007095513-A1 TETRAHYDR0-2H-INDAZ0LE DERIVATIVES FOR USE AS CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, NV (BE) 2007-08-23 WO 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-20080058313-A1 TETRAHYDRO-2H-INDAZOLE PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, GPR35 CNR1 1/4885CNR2 2/4885CFTR 1781/4885

“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.