SCHEMBL4718655

SCHEMBL4718655

Cn1ncc2c(Nc3cc(-c4ccc(C(F)(F)F)cc4)ncn3)cccc21

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.59
ABL1 P00519 5/20 0.48
BCR P11274 5/20 0.48
RAF1 P04049 1/20 0.44
BRAF P15056 1/20 0.44
FAAH O00519 1/20 0.42

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
SCHEMBL4717813 0.89 TRPV1 (0.51) TRPV1ABL1BCRBRAFFAAH
SCHEMBL4717900 0.88 TRPV1 (0.52) TRPV1ABL1BCRFAAH
SCHEMBL4718644 0.84 TRPV1 (0.44) TRPV1ABL1RAF1BRAF
SCHEMBL4720717 0.80 TRPV1 (0.56) TRPV1ABL1BCRFAAH
SCHEMBL13868149 0.80 TRPV1 (0.55) TRPV1ABL1BCRFAAH
SCHEMBL4718707 0.80 TRPV1 (0.44) TRPV1RAF1BRAF
SCHEMBL4819487 0.79 TRPV1 (0.55) TRPV1ABL1BCRFAAH
SCHEMBL1013757 0.79 TRPV1 (0.78) TRPV1ABL1BCRFAAH
SCHEMBL4715969 0.78 TRPV1 (0.69) TRPV1ABL1BCRFAAH
SCHEMBL4715597 0.77 TRPV1 (0.61) TRPV1ABL1BCRRAF1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7442701-B2 Amino-heterocycles as VR-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2008-10-28 US disclosed
EP-1562934-B1 AMINO-HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME (GB) 2008-03-26 EP disclosed
US-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2006-02-23 US disclosed
EP-1562934-A1 AMINO-HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LTD. (GB) 2005-08-17 EP disclosed
WO-2004046133-A1 AMINO-HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LIMITED (GB) 2004-06-03 WO 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-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain OPRL1, CNR1, GPR6 TRPV1 40/4885ABL1 3380/4885BCR 2892/4885

“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.