SCHEMBL4643631

SCHEMBL4643631

OC1CCc2c(Br)ccc(Nc3cc(-c4ccc(C(F)(F)F)cc4)ncn3)c2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 18/20 1.00
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.40
FAAH O00519 1/20 0.40

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
SCHEMBL4646650 1.00 TRPV1 (1.00) TRPV1ABL1BCRTRPM8FAAH
SCHEMBL4641050 0.89 TRPV1 (1.00) TRPV1ABL1BCRTRPM8FAAH
SCHEMBL4644184 0.89 TRPV1 (1.00) TRPV1ABL1BCRTRPM8FAAH
SCHEMBL4642701 0.89 TRPV1 (1.00) TRPV1ABL1BCRTRPM8FAAH
SCHEMBL4641082 0.83 TRPV1 (1.00) TRPV1TRPM8
SCHEMBL4642791 0.83 TRPV1 (1.00) TRPV1TRPM8
SCHEMBL4642825 0.83 TRPV1 (1.00) TRPV1TRPM8
SCHEMBL4641090 0.81 TRPV1 (1.00) TRPV1ABL1BCRTRPM8
SCHEMBL4621477 0.78 TRPV1 (0.83) TRPV1ABL1BCRTRPM8FAAH
SCHEMBL5917099 0.78 TRPV1 (0.83) TRPV1ABL1BCRTRPM8FAAH

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-1883632-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS Amgen Inc. (US) 2008-02-06 EP disclosed
WO-2006116563-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2006-11-02 WO disclosed
US-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol AMGEN INC. 2006-10-26 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-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol TRPV1, HRH2, TRPA1 TRPV1 1/4885ABL1 1051/4885BCR 588/4885

“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.