SCHEMBL909080

SCHEMBL909080

O=C(O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1CO

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.59
CNR2 P34972 14/20 0.58
RPA1 P27694 1/20 0.54

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
SCHEMBL4906387 0.94 CNR1 (0.56) CNR1CNR2
SCHEMBL4907403 0.91 CNR1 (0.56) CNR1CNR2
SCHEMBL2873006 0.89 CNR2 (0.61) CNR1CNR2
SCHEMBL3247323 0.89 CNR2 (0.57) CNR1CNR2RPA1
SCHEMBL8018768 0.89 CNR2 (0.57) CNR1CNR2RPA1
SCHEMBL908827 0.89 CNR2 (0.60) CNR1CNR2
Hydrochloric Acid SCHEMBL9160043 0.88 CNR2 (0.60) CNR1CNR2
SCHEMBL8013386 0.87 CNR2 (0.58) CNR1CNR2
SCHEMBL4193262 0.87 CNR1 (0.60) CNR1CNR2
Hydrochloric Acid SCHEMBL8016462 0.86 CNR2 (0.57) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875646-B2 Cannabinoid receptor antagonist; N-{[5-(4-chlorophenyl)-4-cyano-1-(2,4-dichlorophenyl)-1H-pyrazol-3-yl]methyl}-3-cyanobenzenesulfonamide; psychiatric disorder, substance dependence and withdrawal disorder, cognitive disorder, ADD, neurodegenerative diseases, pain, eating disorders, dyslipidemia, ulcer SANOFI-AVENTIS (FR) 2011-01-25 US disclosed
EP-1878723-B1 N-[(1,5-diphenyl-1H-pyrazol-3-yl)methyl]sulfonamide derivatives antagonists of the CB1 cannabinoids receptors SANOFI AVENTIS (FR) 2010-05-26 EP disclosed
US-20080070962-A1 DERIVATIVES OF N-[(1,5-DIPHENYL-1H-PYRAZOL-3-YL)METHYL] SULFONAMIDE, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-03-20 US disclosed
EP-1878723-A1 N-[(1,5-diphenyl-1H-pyrazol-3-yl)methyl]sulfonamide derivatives antagonists of the CB1 cannabinoids receptors Sanofi-Aventis (FR) 2008-01-16 EP disclosed
US-7297710-B1 Derivatives of N-[(1,5-diphenyl-1H-pyrazol-3-yl)methyl]sulfonamide, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2007-11-20 US disclosed
US-6028084-A Pyrazole derivatives, method for preparing same, and pharmaceutical compositions containing said derivatives SANOFI-SYNTHELABO (FR) 2000-02-22 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-20080070962-A1 DERIVATIVES OF N-[(1,5-DIPHENYL-1H-PYRAZOL-3-YL)METHYL] SULFONAMIDE, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS PRMT5, PRMT3, PRMT1 CNR1 93/4885CNR2 89/4885RPA1 4336/4885

“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.