SCHEMBL2319045

SCHEMBL2319045

CC1(CF)CC(O)c2ccc(C(F)(F)F)cc2O1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.48

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
SCHEMBL3323004 1.00 TRPV1 (0.48) TRPV1
SCHEMBL3320798 1.00 TRPV1 (0.48) TRPV1
SCHEMBL3322485 0.85 TRPV1 (0.48) TRPV1
SCHEMBL3326867 0.85 TRPV1 (0.48) TRPV1
SCHEMBL3322847 0.84 TRPV1 (0.46) TRPV1
SCHEMBL3320891 0.84 TRPV1 (0.46) TRPV1
SCHEMBL3317955 0.84 TRPV1 (0.46) TRPV1
Hydrochloric Acid SCHEMBL17708768 0.83 TRPV1 (0.45) TRPV1
SCHEMBL15021517 0.81 MAP3K14 (0.47) TRPV1
SCHEMBL15022431 0.81 MAP3K14 (0.47) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2352726-A1 TRPV1 ANTAGONISTS Abbott Laboratories (US) 2011-08-10 EP disclosed
EP-2352727-A1 TRPV1 ANTAGONISTS Abbott Laboratories (US) 2011-08-10 EP disclosed
WO-2010045401-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-04-22 WO disclosed
WO-2010045402-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2010-04-22 WO disclosed