SCHEMBL1769066

SCHEMBL1769066

O=C(O)c1ccc(CCCO)c(CCCO)c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.36
CYP1A2 P05177 1/20 0.34
BID P55957 4/20 0.33
MCL1 Q07820 4/20 0.33
BCL2L1 Q07817 3/20 0.33
BAK1 Q16611 3/20 0.33
FOLH1 Q04609 3/20 0.33
KAT8 Q9H7Z6 2/20 0.33
PPARA Q07869 2/20 0.33
HTT P42858 1/20 0.33
PPARG P37231 1/20 0.33
EP300 Q09472 1/20 0.33
KAT2A Q92830 1/20 0.33
KAT2B Q92831 1/20 0.33
KAT5 Q92993 1/20 0.33
SAE1 Q9UBE0 1/20 0.33
CA2 P00918 1/20 0.33
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32

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
SCHEMBL1768746 0.95 DHODH (0.38) DHODHCYP1A2BIDMCL1BCL2L1
SCHEMBL11766085 0.88 CA2 (0.34) DHODHCA2
SCHEMBL11797565 0.87 DHODH (0.32) DHODHCA2
Cetyl Alcohol SCHEMBL9139758 0.87 PPARA (0.46) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1193578 0.86 BID (0.36) DHODHCYP1A2BIDMCL1BCL2L1
SCHEMBL33516 0.86 PTPN1 (0.39) CYP1A2FOLH1PTPN1
SCHEMBL11755866 0.85 ACLY (0.32) DHODHBIDMCL1BCL2L1BAK1
SCHEMBL11762008 0.85 ACLY (0.32) DHODHBIDMCL1BCL2L1BAK1
SCHEMBL11758300 0.85 ACLY (0.32) DHODHBIDMCL1BCL2L1BAK1
SCHEMBL11759380 0.85 ACLY (0.32) DHODHBIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013096373-A1 ALIPHATIC-AROMATIC COPOLYETHERESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-27 WO disclosed
US-20130158168-A1 ALIPHATIC-AROMATIC COPOLYETHERESTERS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-06-20 US disclosed
US-20130158196-A1 ALIPHATIC-AROMATIC COPOLYETHERESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-20 US disclosed
US-8409677-B2 Biodegradable starch-containing blend E I DU PONT DE NEMOURS AND COMPANY (US) 2013-04-02 US disclosed
US-20110229674-A1 POLYMERIZATION OF ALIPHATIC-AROMATIC COPOLYETHERESTERS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2011-09-22 US disclosed
US-20110213055-A1 COPOLYESTERS WITH ENHANCED TEAR STRENGTH E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-09-01 US disclosed
EP-2358781-A1 COPOLYESTERS WITH ENHANCED TEAR STRENGTH E. I. du Pont de Nemours and Company (US) 2011-08-24 EP disclosed
EP-2358783-A1 POLYMERIZATION OF ALIPHATIC-AROMATIC COPOLYETHERESTERS E. I. du Pont de Nemours and Company (US) 2011-08-24 EP disclosed
WO-2011091130-A1 BIODEGRADABLE STARCH-CONTAINING BLEND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-07-28 WO disclosed
US-20110177275-A1 BIODEGRADABLE STARCH-CONTAINING BLEND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-07-21 US disclosed
WO-2011062600-A1 POLYCONDENSATION WITH A KNEADER REACTOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-05-26 WO disclosed
WO-2010077804-A1 COPOLYESTERS WITH ENHANCED TEAR STRENGTH E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-08 WO disclosed
WO-2010075030-A1 POLYMERIZATION OF ALIPHATIC-AROMATIC COPOLYETHERESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-01 WO disclosed