SCHEMBL39503

SCHEMBL39503

CCCCCCc1c(C(=O)O)cc(N)c(O)c1C(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 4/20 0.44
PPARA Q07869 2/20 0.44
STAT3 P40763 1/20 0.42
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
PPARG P37231 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KAT5 Q92993 1/20 0.41
SAE1 Q9UBE0 1/20 0.41
RARB P10826 1/20 0.41
PLK1 P53350 4/20 0.40
PLK3 Q9H4B4 3/20 0.40

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
SCHEMBL1734363 0.89 ALDH1A1 (0.45)
SCHEMBL29510566 0.82 STAT3 (0.42) KAT8PPARASTAT3BIDMCL1
SCHEMBL630807 0.82 PLK1 (0.45) KAT8PPARASTAT3BIDMCL1
SCHEMBL288470 0.82 STAT3 (0.42) KAT8PPARASTAT3BIDMCL1
Benzoic Acid SCHEMBL30622599 0.81 STAT3 (0.41) KAT8PPARASTAT3BIDMCL1
SCHEMBL27818384 0.80 KAT8 (0.51) KAT8PPARASTAT3BIDMCL1
SCHEMBL28169033 0.79 ALDH1A1 (0.41) PPARAPPARG
Dibenzoylmethane SCHEMBL30439938 0.78 STAT3 (0.39) KAT8PPARASTAT3PLK1PLK3
SCHEMBL29067600 0.78 CES2 (0.45) PPARAPPARG
SCHEMBL29067594 0.78 CES2 (0.45) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1677742-A1 POWDERY PREPARATIONS CONTAINING DIETHYLAMINO-HYDROXYBENZOYL-HEXYL-BENZOATE BASF Aktiengesellschaft (DE) 2006-07-12 EP claimed
WO-2005025529-A1 POWDERY PREPARATIONS CONTAINING DIETHYLAMINO-HYDROXYBENZOYL-HEXYL-BENZOATE BASF AKTIENGESELLSCHAFT (DE) 2005-03-24 WO claimed
EP-2584896-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2013-05-01 EP disclosed
EP-2557917-A1 UV ABSORBER FOR REDUCING THE E/Z ISOMERIZATION OF PESTICIDES BASF SE (DE) 2013-02-20 EP disclosed
EP-2418944-A2 METHOD FOR COMBATING HARMFUL FUNGI BASF SE (DE) 2012-02-22 EP disclosed
EP-2413691-A2 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS BASF SE (DE) 2012-02-08 EP disclosed
WO-2011161105-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2011-12-29 WO disclosed
WO-2011141264-A1 UV ABSORBER FOR REDUCING THE E/Z ISOMERIZATION OF PESTICIDES BASF SE (DE) 2011-11-17 WO disclosed
WO-2011089105-A1 A METHOD FOR CONTROLLING ARTHROPODS COMPRISING THE SPOT-WISE APPLICATION OF A GEL BASF SE (DE) 2011-07-28 WO disclosed
WO-2010115721-A2 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS BASF SE (DE) 2010-10-14 WO disclosed
WO-2010115720-A2 METHOD FOR COMBATING HARMFUL FUNGI BASF SE (DE) 2010-10-14 WO disclosed