SCHEMBL9979564

SCHEMBL9979564

O=C(O)CC1CCc2cc(OCc3cccc4c3CN(c3ccc(C(F)(F)F)cc3)C4=O)ccc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.59
PPARA Q07869 9/20 0.59
FFAR1 O14842 1/20 0.45
PPARG P37231 2/20 0.45

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
SCHEMBL9979641 1.00 PPARD (0.59) PPARDPPARAFFAR1PPARG
SCHEMBL9979670 0.95 PPARD (0.53) PPARDPPARAFFAR1PPARG
SCHEMBL9979688 0.92 PPARD (0.59) PPARDPPARAFFAR1PPARG
SCHEMBL9979463 0.92 PPARD (0.59) PPARDPPARAFFAR1PPARG
SCHEMBL9979638 0.90 PPARD (0.47) PPARDPPARAFFAR1PPARG
SCHEMBL9979485 0.90 PPARD (0.47) PPARDPPARAFFAR1PPARG
SCHEMBL9979653 0.90 PPARD (0.49) PPARDPPARAFFAR1
SCHEMBL9979490 0.90 PPARD (0.53) PPARDPPARAFFAR1PPARG
SCHEMBL9979650 0.90 PPARD (0.49) PPARDPPARAFFAR1PPARG
SCHEMBL9979488 0.90 PPARD (0.53) PPARDPPARAFFAR1PPARG

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-2012081570-A1 LACTAM COMPOUND OR A SALT THEREOF, AND PPAR ACTIVATOR あすか製薬株式会社 (JP) 2012-06-21 WO disclosed