SCHEMBL10885451

SCHEMBL10885451

O=C(O)c1cccc(CCCCc2cccc(C(=O)O)c2C(=O)O)c1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 7/20 0.56
MCL1 Q07820 7/20 0.56
BCL2L1 Q07817 6/20 0.56
BAK1 Q16611 6/20 0.56
PPARA Q07869 3/20 0.56
KAT8 Q9H7Z6 2/20 0.56
PPARG P37231 2/20 0.56
FOLH1 Q04609 2/20 0.56
SAE1 Q9UBE0 2/20 0.56
EP300 Q09472 1/20 0.56
KAT2A Q92830 1/20 0.56
KAT2B Q92831 1/20 0.56
KAT5 Q92993 1/20 0.56
HMGB1 P09429 1/20 0.49
SLC16A3 O15427 1/20 0.48
MMP2 P08253 2/20 0.48
F7 P08709 2/20 0.48
F3 P13726 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL9330418 0.98 BID (0.58) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL211983 0.98 BID (0.58) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5114102 0.96 FOLH1 (0.56) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL29076358 0.93 BID (0.50) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6004170 0.92 FOLH1 (0.57) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL22912 0.92 FOLH1 (0.59) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL30069215 0.91 BID (0.69) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL11052053 0.91 BID (0.53) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL1029926 0.91 BID (0.69) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL5695801 0.91 FOLH1 (0.51) BIDMCL1BCL2L1BAK1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0117912-B1 PROCESS FOR PRODUCING LIGHTLY COLOURED POLYESTERS BY USING TITANIUM CATALYSTS HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1986-10-08 EP disclosed
EP-0117912-A1 Process for producing lightly coloured polyesters by using titanium catalysts HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1984-09-12 EP disclosed