SCHEMBL3322165

SCHEMBL3322165

O[C@H]1CC(CF)(CF)Oc2c(F)cccc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 17/20 0.44
CYP2D6 P10635 1/20 0.43
TRPM8 Q7Z2W7 4/20 0.41
SCD O00767 1/20 0.36

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
SCHEMBL3324035 1.00 TRPV1 (0.44) TRPV1CYP2D6TRPM8SCD
SCHEMBL3322042 0.84 TRPM8 (0.40) TRPV1CYP2D6TRPM8SCD
SCHEMBL3320421 0.84 TRPM8 (0.40) TRPV1CYP2D6TRPM8SCD
SCHEMBL3324617 0.84 TRPV1 (0.43) TRPV1CYP2D6TRPM8
SCHEMBL3324623 0.84 TRPV1 (0.43) TRPV1CYP2D6TRPM8
SCHEMBL2317663 0.82 TRPV1 (0.41) TRPV1CYP2D6
SCHEMBL2317667 0.82 TRPV1 (0.41) TRPV1CYP2D6
SCHEMBL3323873 0.79 TRPV1 (0.44) TRPV1CYP2D6
SCHEMBL3323877 0.79 TRPV1 (0.44) TRPV1CYP2D6
SCHEMBL17112284 0.78 TRPV1 (0.43) TRPV1TRPM8SCD

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-8609692-B2 TRPV1 antagonists ABBVIE INC. (US) 2013-12-17 US disclosed
US-8604053-B2 TRPV1 antagonists ABBVIE INC. (US) 2013-12-10 US disclosed
US-20100137360-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-06-03 US disclosed
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20100120846-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-05-13 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 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 (4 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-20100137360-A1 TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPV2 TRPV1 1/4885CYP2D6 878/4885TRPM8 8/4885
US-20100120846-A1 TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPV2 TRPV1 1/4885CYP2D6 875/4885TRPM8 8/4885
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors HSD3B1, HSD3B2, HSD11B1 TRPV1 4869/4885CYP2D6 108/4885TRPM8 4621/4885
US-20100120789-A1 Compound NR0B2, NR0B1, NR4A1 TRPV1 3613/4885CYP2D6 228/4885TRPM8 2044/4885

“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.