SCHEMBL9979534

SCHEMBL9979534

Cc1ccc(N2Cc3c(COc4ccc5c(c4)SCC5CC(=O)O)cccc3C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.49
PPARD Q03181 5/20 0.38
PPARG P37231 3/20 0.37
UGCG Q16739 2/20 0.36
HTT P42858 1/20 0.35
CD274 Q9NZQ7 1/20 0.34
PPARA Q07869 1/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL9979578 0.92 FFAR1 (0.43) FFAR1UGCGCD274NPC1PKM
SCHEMBL9979503 0.90 FFAR1 (0.44) FFAR1PPARDPPARGUGCGPPARA
SCHEMBL9979533 0.90 FFAR1 (0.44) FFAR1PPARDPPARGUGCGPPARA
SCHEMBL9979488 0.84 PPARD (0.53) FFAR1PPARDPPARGPPARA
SCHEMBL9979490 0.84 PPARD (0.53) FFAR1PPARDPPARGPPARA
SCHEMBL9979526 0.84 FFAR1 (0.58) FFAR1PPARDPPARG
SCHEMBL9979511 0.83 FFAR1 (0.52) FFAR1PPARDPPARGCD274PPARA
SCHEMBL9979505 0.83 FFAR1 (0.39) FFAR1PPARDUGCGPPARAFFAR4
SCHEMBL9979607 0.83 FFAR1 (0.39) FFAR1PPARDPPARGUGCGPPARA
SCHEMBL9979500 0.78 PPARD (0.51) FFAR1PPARDPPARGUGCGCD274

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