SCHEMBL15021679

SCHEMBL15021679

CC1(C)C[C@@H](NC(=O)Nc2ccc(F)c3c2C[C@H](O)C3)c2ccc(F)cc2O1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 19/20 0.73
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 1/20 0.58
CFTR P13569 1/20 0.50

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
SCHEMBL15021223 1.00 TRPV1 (0.73) TRPV1CYP3A4CYP2D6CFTR
SCHEMBL15021195 0.93 TRPV1 (0.63) TRPV1CYP3A4CYP2D6
SCHEMBL15021658 0.93 TRPV1 (0.63) TRPV1CYP3A4CYP2D6
SCHEMBL15021665 0.93 TRPV1 (0.63) TRPV1CYP3A4
SCHEMBL15021566 0.93 TRPV1 (0.63) TRPV1CYP3A4
SCHEMBL15021418 0.89 TRPV1 (0.58) TRPV1CYP3A4
SCHEMBL15021668 0.89 TRPV1 (0.58) TRPV1CYP3A4
SCHEMBL15021579 0.89 TRPV1 (0.62) TRPV1
SCHEMBL15021191 0.89 TRPV1 (0.62) TRPV1
SCHEMBL15021189 0.89 TRPV1 (0.85) TRPV1CYP3A4CYP2D6

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
US-8859584-B2 TRPV1 antagonists ABBVIE, INC. (US) 2014-10-14 US claimed
WO-2013096223-A1 TRPV1 ANTAGONISTS ABBVIE INC. (US) 2013-06-27 WO claimed
US-20130158067-A1 TRPV1 Antagonists ABBVIE INC. (US) 2013-06-20 US claimed
US-8859584-B2 TRPV1 antagonists ABBVIE, INC. (US) 2014-10-14 US disclosed
WO-2013096223-A1 TRPV1 ANTAGONISTS ABBVIE INC. (US) 2013-06-27 WO disclosed
US-20130158067-A1 TRPV1 Antagonists ABBVIE INC. (US) 2013-06-20 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-20130158067-A1 TRPV1 Antagonists TRPV1, NPY1R, MRGPRX1 TRPV1 1/4885CYP3A4 3516/4885CYP2D6 2313/4885

“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.