SCHEMBL6668331

SCHEMBL6668331

CCCC(COCc1ccccc1)C(=O)N1C(=O)OCC1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.44
IL6ST P40189 1/20 0.38
FAAH O00519 1/20 0.38
SLC1A1 P43005 1/20 0.37
NAAA Q02083 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PPARG P37231 1/20 0.36
PSMB11 A5LHX3 1/20 0.36
PSMD11 O00231 1/20 0.36
PSMD12 O00232 1/20 0.36
PSMD14 O00487 1/20 0.36
PSMA7 O14818 1/20 0.36
PSMD3 O43242 1/20 0.36
PSMC3 P17980 1/20 0.36
PSMB1 P20618 1/20 0.36
PSMA1 P25786 1/20 0.36
PSMA2 P25787 1/20 0.36
PSMA3 P25788 1/20 0.36
PSMA4 P25789 1/20 0.36
PSMB8 P28062 1/20 0.36

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
SCHEMBL6668597 1.00 PPARA (0.44) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL6668336 1.00 PPARA (0.44) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL8811308 0.94 PPARA (0.46) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL8887105 0.94 PPARA (0.46) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL132735 0.93 PPARA (0.47) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL132736 0.93 PPARA (0.47) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL6069116 0.92 PPARA (0.43) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL6068526 0.92 PPARA (0.43) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL6068528 0.92 PPARA (0.43) PPARAIL6STFAAHSLC1A1NAAA
SCHEMBL16898532 0.91 FAAH (0.40) PPARAIL6STFAAHSLC1A1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370547-B1 BENZOAXATHIEPIN DERIVATIVES AND THEIR USE AS MEDICINES PF MEDICAMENT (FR) 2004-09-15 EP disclosed
EP-1370547-A1 BENZOAXATHIEPIN DERIVATIVES AND THEIR USE AS MEDICINES PIERRE FABRE MEDICAMENT (FR) 2003-12-17 EP disclosed
WO-2002081464-A1 BENZOAXATHIEPIN DERIVATIVES AND THEIR USE AS MEDICINES PIERRE FABRE MEDICAMENT (FR) 2002-10-17 WO disclosed