SCHEMBL9979511

SCHEMBL9979511

Cc1ccc(N2Cc3c(COc4ccc5c(c4)CCCC5CC(=O)O)cccc3C2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.52
PPARD Q03181 12/20 0.47
PPARA Q07869 6/20 0.45
PPARG P37231 4/20 0.45
CD274 Q9NZQ7 1/20 0.42

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
SCHEMBL9979488 0.95 PPARD (0.53) FFAR1PPARDPPARAPPARG
SCHEMBL9979490 0.95 PPARD (0.53) FFAR1PPARDPPARAPPARG
SCHEMBL9979519 0.91 FFAR1 (0.43) FFAR1PPARDPPARAPPARGCD274
SCHEMBL9979670 0.90 PPARD (0.53) FFAR1PPARDPPARAPPARG
SCHEMBL9979521 0.90 PPARD (0.53) FFAR1PPARDPPARAPPARG
SCHEMBL9979650 0.87 PPARD (0.49) FFAR1PPARDPPARAPPARG
SCHEMBL9979653 0.87 PPARD (0.49) FFAR1PPARDPPARA
SCHEMBL9979572 0.86 PPARD (0.43) FFAR1PPARDPPARAPPARGCD274
SCHEMBL9979690 0.86 PPARD (0.43) FFAR1PPARDPPARAPPARGCD274
SCHEMBL9979688 0.85 PPARD (0.59) FFAR1PPARDPPARAPPARG

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