SCHEMBL908989

SCHEMBL908989

COc1cccc(S(=O)(=O)NCc2nn(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)c2C#N)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.51
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.43
OPRL1 P41146 4/20 0.42
KCNH2 Q12809 2/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
MALT1 Q9UDY8 1/20 0.41
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL5621822 0.98 CNR1 (0.49) CNR1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL909395 0.91 CNR1 (0.49) CNR1OPRL1KCNH2
SCHEMBL908264 0.88 CNR1 (0.47) CNR1OPRL1KCNH2MALT1
SCHEMBL2770695 0.88 OPRL1 (0.56) CNR1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL907790 0.86 CNR1 (0.54) CNR1OPRL1KCNH2
SCHEMBL908379 0.86 CNR1 (0.52) CNR1OPRL1KCNH2
SCHEMBL1377324 0.84 OPRL1 (0.51) CNR1OPRL1KCNH2
SCHEMBL1379205 0.82 CNR1 (0.49) CNR1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL908983 0.82 OPRL1 (0.47) CNR1OPRL1KCNH2
SCHEMBL1377597 0.81 OPRL1 (0.54) CNR1OPRL1KCNH2

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 claimed
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 claimed
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 claimed
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 claimed
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
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

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 93/4885MEN1 1128/4885MAPT 3893/4885

“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.