SCHEMBL5658533

SCHEMBL5658533

COC(=O)c1nccc2c(NC(=O)NCc3ccc(C(F)(F)F)cc3)cccc12

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 14/20 0.62
ALDH1A1 P00352 3/20 0.50
NAMPT P43490 2/20 0.48
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MTOR P42345 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL5659104 0.89 TRPV1 (0.66) TRPV1NAMPTKDM4EMTOR
SCHEMBL5658543 0.85 TRPV1 (0.67) TRPV1NAMPTKDM4EMTOR
SCHEMBL5658381 0.84 TRPV1 (0.66) TRPV1ALDH1A1NAMPTKDM4EMEN1
SCHEMBL5661517 0.84 TRPV1 (0.68) TRPV1NAMPTKDM4EMTOR
SCHEMBL5658537 0.83 TRPV1 (0.67) TRPV1NAMPTKDM4EMTOR
SCHEMBL5658536 0.83 TRPV1 (0.67) TRPV1NAMPTKDM4EMTOR
SCHEMBL5658839 0.82 TRPV1 (0.63) TRPV1NAMPTMTOR
SCHEMBL5656204 0.80 TRPV1 (0.63) TRPV1NAMPTKDM4EMTOR
SCHEMBL5657625 0.80 TRPV1 (0.68) TRPV1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6686578 0.80 TRPV1 (0.68) TRPV1ALDH1A1KDM4EMEN1KMT2A

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-7285563-B2 Heteroaromatic urea derivatives as VR-1 receptor modulators for treating pain MERCK SHARP & DOHME LTD. (GB) 2007-10-23 US disclosed
US-20050107388-A1 Heteroaromatic urea derivatives as vr-1receptor modulators for treating pain MERCK SHARP & DOHME LTD. (GB) 2005-05-19 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-20050107388-A1 Heteroaromatic urea derivatives as vr-1receptor modulators for treating pain ARRB1, OPRL1, CNR1 TRPV1 37/4885ALDH1A1 1267/4885NAMPT 1466/4885

“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.