SCHEMBL3323280

SCHEMBL3323280

CCC1(CC)CC(O)c2cccc(OC(F)(F)F)c2O1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.37
TRPM8 Q7Z2W7 9/20 0.37
HCRTR1 O43613 2/20 0.34
HCRTR2 O43614 2/20 0.34
FFAR1 O14842 1/20 0.34
KDM1A O60341 1/20 0.32
RCOR1 Q9UKL0 1/20 0.32

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
SCHEMBL3323275 1.00 TRPV1 (0.37) TRPV1TRPM8HCRTR1HCRTR2FFAR1
SCHEMBL3322931 0.89 TRPM8 (0.38) TRPV1TRPM8HCRTR1HCRTR2
SCHEMBL3322927 0.89 TRPM8 (0.38) TRPV1TRPM8HCRTR1HCRTR2
SCHEMBL3322640 0.85 KDM1A (0.34) TRPV1HCRTR1HCRTR2FFAR1KDM1A
SCHEMBL3322635 0.85 KDM1A (0.34) TRPV1HCRTR1HCRTR2FFAR1KDM1A
SCHEMBL3322941 0.83 TRPM8 (0.39) TRPV1TRPM8FFAR1
SCHEMBL3322936 0.83 TRPM8 (0.39) TRPV1TRPM8FFAR1
SCHEMBL3324797 0.81 FFAR1 (0.36) TRPV1TRPM8FFAR1
SCHEMBL3324792 0.81 FFAR1 (0.36) TRPV1TRPM8FFAR1
SCHEMBL3323444 0.73 TRPV1 (0.32) TRPV1

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
CN-102245587-A Trpv1 antagonists ABBOTT LAB 2011-11-16 CN disclosed
CN-102186836-A Trpv1 antagonists ABBOTT LAB 2011-09-14 CN disclosed
US-20100137360-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-06-03 US disclosed
US-20100120846-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-05-13 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 (2 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 1/4885TRPM8 8/4885HCRTR1 121/4885
US-20100120846-A1 TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPV2 TRPV1 1/4885TRPM8 8/4885HCRTR1 122/4885

“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.