SCHEMBL12358693

SCHEMBL12358693

CS(=O)(=O)Nc1ccccc1-c1ccc2[nH]c(-c3ccc(S(C)(=O)=O)cc3)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCD O00767 6/20 0.53
FADS1 O60427 1/20 0.53
NPBWR1 P48145 1/20 0.52
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
TRPV1 Q8NER1 6/20 0.48

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
SCHEMBL12359106 0.89 TRPV1 (0.60) SCDFADS1TRPV1
SCHEMBL12358846 0.89 SCD (0.51) SCDFADS1NPBWR1MEN1NPC1
SCHEMBL1795732 0.84 TRPV1 (0.45) NPC1RAB9ATRPV1
SCHEMBL12359118 0.84 TRPV1 (0.52) SCDNPBWR1TRPV1
SCHEMBL1798334 0.83 TRPV1 (0.71) TRPV1
SCHEMBL1798331 0.83 TRPV1 (0.71) TRPV1
SCHEMBL1799027 0.83 TRPV1 (0.46) TRPV1
SCHEMBL12358865 0.83 TRPV1 (0.48) SCDFADS1TRPV1
SCHEMBL12358818 0.81 HDAC6 (0.46) SCDFADS1TRPV1
SCHEMBL12358702 0.81 TRPV1 (0.54) NPBWR1TRPV1

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-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2011-08-04 US disclosed
US-20110190364-A1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2011-08-04 US disclosed
US-7951829-B2 Benzimidazole modulators of VR1 JANSSEN PHARMACEUTICA NV (BE) 2011-05-31 US disclosed
US-20070259936-A1 Benzimidazole Modulators of VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-08 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 (3 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-20110190364-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 SCD 4754/4885FADS1 4059/4885NPBWR1 1487/4885
US-20070259936-A1 Benzimidazole Modulators of VR1 VRK1, VRK2, VIL1 SCD 4754/4885FADS1 4059/4885NPBWR1 1487/4885
US-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 SCD 4754/4885FADS1 4059/4885NPBWR1 1487/4885

“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.