SCHEMBL2456552

SCHEMBL2456552

O=C(O)c1ccc(C(=O)OCC=C(O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
TRPV1 Q8NER1 1/20 0.45
ALDH1A1 P00352 2/20 0.44
SRD5A2 P31213 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
SNCA P37840 1/20 0.41
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 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
SCHEMBL10424971 0.85 TRPV1 (0.57) MAPTTP53TSHRTRPV1ALDH1A1
SCHEMBL9296377 0.82 MAPT (0.50) MAPTTP53TSHRALDH1A1SRD5A2
Terephthalic Acid SCHEMBL10597123 0.82 TSHR (0.52) TP53TSHRALDH1A1SRD5A2
SCHEMBL175787 0.81 SNCA (0.59) MAPTTP53TSHRALDH1A1SRD5A2
SCHEMBL175075 0.79 MAPT (0.47) MAPTTP53TSHRALDH1A1SRD5A2
Hydrochloric Acid SCHEMBL9285006 0.79 SNCA (0.58) MAPTTP53TSHRALDH1A1SRD5A2
Bicarbonate SCHEMBL6554150 0.79 SNCA (0.58) MAPTTP53TSHRALDH1A1SRD5A2
SCHEMBL27370343 0.78 MAPT (0.50) MAPTTP53TSHRTRPV1ALDH1A1
SCHEMBL1081433 0.77 TSHR (0.57) MAPTTP53TSHRALDH1A1SRD5A2
SCHEMBL31298566 0.77 TDP1 (0.59) MAPTTP53TSHRALDH1A1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4104263-A ANTIMONY OR ZIRCONIUM CARBOXYLATES, CALCIUM MANGANESE OR ZINC CARBOXYLATES, ANHYDRIDES, ALCOHOLS, OR GLYCOLS M&T CHEMICALS INC. (US) 1978-08-01 US claimed
CN-110776629-A Cationic dyeable polyester and preparation method thereof 远东新世纪股份有限公司 2020-02-11 CN disclosed
EP-1671999-B1 PROCESS FOR PRODUCING POLYALKYLENE TEREPHTHALATE, PROCESS FOR PRODUCING POLYALKYLENE TEREPHTHALATE MOLDING AND POLYALKYLENE TEREPHTHALATE MOLDING ASAHI CHEMICAL IND (JP) 2016-12-07 EP disclosed
EP-2565226-A1 Method of obtaining aromatic polyester-ether polyols from waste poly (ethylene terephthalate) (PET) and aromatic polyester-ether polyols incorporating poly(ethylene terephthalate) wastes and renewable materials, obtained by respective procedure Institutul National de Cercetare Dezvoltare Pentru Chimie si Petrochimie - Icechim (RO) 2013-03-06 EP disclosed
US-8013107-B2 Process for producing polyalkylene terephthalate, process for producing polyalkylene terephthalate molding and polyalkylene terephthalate molding ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-09-06 US disclosed
US-20080274320-A1 Process for Producing Polyalkylene Terephthalate, Process for Producing Polyalkylene Terephthalate Molding and Polyalkylene Terephthalate Molding ASAHI KASEI CHEMICALS CORPORATION (JP) 2008-11-06 US disclosed
EP-1671999-A1 PROCESS FOR PRODUCING POLYALKYLENE TEREPHTHALATE, PROCESS FOR PRODUCING POLYALKYLENE TEREPHTHALATE MOLDING AND POLYALKYLENE TEREPHTHALATE MOLDING Asahi Kasei Chemicals Corporation (JP) 2006-06-21 EP disclosed
EP-0890622-B1 COATING COMPOSITION FOR PRECOATED STEEL SHEET, PRECOATED STEEL SHEET, AND PROCESS FOR PREPARING THE SAME JFE STEEL CORP (JP) 2004-07-21 EP disclosed
JP-2002087999-A METHOD FOR RECOVERING EFFECTIVE COMPONENT FROM POLYESTER WASTE TEIJIN LTD 2002-03-27 JP disclosed
US-6136455-A THERMOSETTING COATING COMPOSITION FOR PRECOATED STEEL SHEETS WHICH ARE REQUIRED TO HAVE HIGH HARDNESS, GOOD WORKABILITY AND STAIN RESISTANCE NKK CORPORATION (JP) 2000-10-24 US disclosed
US-6018013-A CONSISTS OF A POLYESTER OF GIVEN FORMULA DERIVED FROM 1,4-CYCLOHEXANEDICARBOXYLIC ACID AND A DIOL; A POLYOL; AND CURING AGENT; WORKABILITY AND HARDNESS NKK CORPORATION (JP) 2000-01-25 US disclosed
EP-0890622-A1 COATING COMPOSITION FOR PRECOATED STEEL SHEET, PRECOATED STEEL SHEET, AND PROCESS FOR PREPARING THE SAME NKK CORPORATION (JP) 1999-01-13 EP disclosed
US-5817731-A POLYESTERDIOL NKK CORPORATION (JP) 1998-10-06 US disclosed
US-5782935-A DISPERSE DYES DEGUSSA AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed