SCHEMBL2345110

SCHEMBL2345110

COC(=O)c1ccc(NC(=O)c2cccc3c2OCCN3c2ncccc2Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 3/20 0.42
TRPV1 Q8NER1 2/20 0.42
GRM1 Q13255 1/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
TOP1 P11387 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM4 Q14833 1/20 0.39

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
SCHEMBL1549275 0.91 TRPV1 (0.43) L3MBTL1ALDH1A1TRPV1GRM1MAPT
SCHEMBL2348370 0.90 TRPV1 (0.43) L3MBTL1ALDH1A1TRPV1GRM1MAPT
SCHEMBL2345220 0.90 L3MBTL1 (0.55) L3MBTL1ALDH1A1TRPV1GAAMAPT
SCHEMBL1549272 0.90 ALDH1A1 (0.43) ALDH1A1TRPV1GRM1MAPTSMN1; SMN2
SCHEMBL2348926 0.89 ALDH1A1 (0.43) ALDH1A1TRPV1GRM1MAPTSMN1; SMN2
SCHEMBL2345187 0.89 KDM4E (0.49) L3MBTL1ALDH1A1TRPV1GRM1MAPT
SCHEMBL2346049 0.89 TRPV1 (0.52) ALDH1A1TRPV1GRM1MAPTSMN1; SMN2
SCHEMBL2351476 0.89 KDM4E (0.42) L3MBTL1ALDH1A1TRPV1GRM1MAPT
SCHEMBL1548738 0.88 KDM4E (0.50) L3MBTL1ALDH1A1GAAMAPTHTT
SCHEMBL2349235 0.88 TRPV1 (0.43) ALDH1A1TRPV1GRM1SMN1; SMN2RAB9A

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
EP-2314585-B1 Condensed benzamide compounds as inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC (JP) 2012-09-12 EP claimed
US-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY JAPAN TOBACCO INC. (JP) 2006-02-16 US claimed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY JAPAN TOBACCO INC. (JP) 2006-02-16 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-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY TRPV1, TRPV2, TRPA1 EGLN1 1937/4885L3MBTL1 3518/4885ALDH1A1 815/4885

“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.