SCHEMBL39502

SCHEMBL39502

CCCCCCc1c(C(=O)O)cccc1C(=O)c1cccc(N)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.53
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
KMT2A Q03164 1/20 0.43
KAT8 Q9H7Z6 5/20 0.43
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
PPARA Q07869 2/20 0.43
EP300 Q09472 2/20 0.43
KAT5 Q92993 2/20 0.43
PPARG P37231 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
PLK1 P53350 5/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 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
SCHEMBL8818591 0.85 ALDH1A1 (0.49) MMP2KAT8BIDMCL1BCL2L1
SCHEMBL27944038 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL27924694 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL27944047 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL14836221 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL8757448 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL27924691 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL28103139 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL27944035 0.83 KAT8 (0.53) KAT8BIDMCL1BCL2L1BAK1
SCHEMBL27600985 0.83 KAT8 (0.52) MMP2KAT8BIDMCL1BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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