SCHEMBL12194

SCHEMBL12194

C=CC[C@]1(O)CC[C@]2(CCN(c3ccc(C(C)C(C)(F)F)cc3)C2=C)CC1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 16/20 0.38

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
SCHEMBL12244 0.83 LIPE (0.34) LIPE
SCHEMBL1589652 0.78 LIPE (0.56) LIPE
SCHEMBL1589654 0.78 LIPE (0.56) LIPE
SCHEMBL12701924 0.78 LIPE (0.56) LIPE
SCHEMBL12701946 0.75 LIPE (0.48) LIPE
SCHEMBL10339 0.75 LIPE (0.48) LIPE
SCHEMBL10340 0.75 LIPE (0.48) LIPE
SCHEMBL12343 0.74
SCHEMBL1589136 0.71 LIPE (0.68) LIPE
SCHEMBL1589660 0.71 LIPE (0.68) LIPE

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011045292-A1 SPIRO-CONDENSED CYCLOHEXANE DERIVATIVES AS HSL INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2011-04-21 WO disclosed