SCHEMBL1389264

SCHEMBL1389264

CC(NC(=O)Cn1cnc2ccc(Cl)c(F)c21)c1ccc(C(C)(C)C#N)cc1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.68
ENPP2 Q13822 1/20 0.41
MAPK1 P28482 1/20 0.40
GPR139 Q6DWJ6 14/20 0.40
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL1389262 1.00 TRPV1 (0.68) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL307996 0.91 TRPV1 (0.82) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL308087 0.91 TRPV1 (0.82) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL307997 0.91 TRPV1 (0.82) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL308037 0.90 TRPV1 (0.69) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL308036 0.90 TRPV1 (0.69) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL14291910 0.90 TRPV1 (0.71) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL306518 0.88 TRPV1 (0.58) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL306519 0.88 TRPV1 (0.58) TRPV1ENPP2MAPK1GPR139ALDH1A1
SCHEMBL308183 0.88 TRPV1 (0.54) TRPV1ENPP2MAPK1GPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2051967-B1 BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATMENT OF VALLINOID RECEPTOR TRPV1 RELATED DISORDERS NEOMED INST (CA) 2014-12-31 EP claimed
US-7906654-B2 (S)(-)-2-(7-chloro-6-fluoro-1H-benzimidazol-1-yl)-N-{1-[4-(1-cyano-1-methylethyl)phenyl]ethyl}acetamide; treatment of pain; vanilloid receptor inhibitor; Antagonists maintain analgesic properties, but avoid pungency and neurotoxicity side effects of agonists ASTRAZENECA AB (SE) 2011-03-15 US disclosed
US-20080221188-A1 New Benzimidazole Derivatives ASTRAZENECA R&D SODERTALJE (SE) 2008-09-11 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-20080221188-A1 New Benzimidazole Derivatives OPRD1, OPRK1, SDHA TRPV1 10/4885ENPP2 3316/4885MAPK1 4150/4885

“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.