SCHEMBL4464625

SCHEMBL4464625

CCc1c(C(=O)NN)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Br)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.75
CNR2 P34972 3/20 0.75
KCNH2 Q12809 1/20 0.67

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
SCHEMBL5332399 0.90 CNR1 (0.69) CNR1CNR2KCNH2
SCHEMBL4462642 0.89 CNR1 (0.71) CNR1CNR2KCNH2
SCHEMBL4466452 0.89 CNR2 (0.71) CNR1CNR2KCNH2
SCHEMBL2873286 0.89 CNR1 (0.70) CNR1CNR2KCNH2
SCHEMBL3999243 0.89 CNR1 (0.70) CNR1CNR2KCNH2
Hydrochloric Acid SCHEMBL6543063 0.88 CNR1 (0.69) CNR1CNR2KCNH2
SCHEMBL30961589 0.88 CNR2 (0.88) CNR1CNR2
SCHEMBL4892080 0.88 CNR1 (0.69) CNR1CNR2KCNH2
Surinabant SCHEMBL675894 0.86 CNR1 (1.00) CNR1CNR2KCNH2
Surinabant SCHEMBL30953789 0.86 CNR1 (1.00) CNR1CNR2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7632852-B2 (1,5-diphenyl-1H-pyrazol-3-yl)oxadiazole derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2009-12-15 US disclosed
US-20080039510-A1 (1,5-DIPHENYL-1H-PYRAZOL-3-YL)OXADIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-02-14 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-20080039510-A1 (1,5-DIPHENYL-1H-PYRAZOL-3-YL)OXADIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS DHFR, DPYD, THPO CNR1 767/4885CNR2 933/4885KCNH2 2530/4885

“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.