SCHEMBL673675

SCHEMBL673675

O=C(O)C(Cc1ccccc1)C(O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
CPA1 P15085 3/20 0.43
CPA3 P15088 3/20 0.43
FOLH1 Q04609 1/20 0.43
CPB1 P15086 1/20 0.43
CPB2 Q96IY4 1/20 0.43
SRR Q9GZT4 2/20 0.42
SLC1A3 P43003 1/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
MME P08473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL11169147 0.87 SMN1; SMN2 (0.43) CYP1A2SMN1; SMN2HIF1AALPIPKM
SCHEMBL304065 0.85 CYP1A2 (0.47) CYP1A2ALPIPKMPTGS1XIAP
Ammonia Solution, Strong SCHEMBL28110561 0.83 CYP1A2 (0.46) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL306315 0.83 CYP1A2 (0.46) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL7270014 0.79 CYP1A2 (0.44) CYP1A2SMN1; SMN2HIF1AALPIPKM
SCHEMBL11472851 0.79 CYP1A2 (0.44) CYP1A2SMN1; SMN2HIF1AALPIPKM
SCHEMBL28214137 0.79 CPT2 (0.50) CYP1A2SMN1; SMN2HIF1AALPIPKM
SCHEMBL20394045 0.79 CYP1A2 (0.52) CYP1A2ALPIPKMPTGS1XIAP
SCHEMBL2677822 0.78 SMN1; SMN2 (0.53) CYP1A2SMN1; SMN2HIF1AALPIPKM
Isothiocyanate SCHEMBL7901465 0.77 HSPD1 (0.40) CYP1A2ALPIPKMPTGS1XIAP

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3521907-B1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2024-12-04 EP disclosed
US-10921489-B2 Polymerizable composition for optical material, optical material obtained from the composition, and plastic lens MITSUI CHEMICALS, INC. (JP) 2021-02-16 US disclosed
EP-3351564-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND OPTICAL MATERIAL AND PLASTIC LENS OBTAINED FROM COMPOSITION MITSUI CHEMICALS INC (JP) 2020-04-15 EP disclosed
EP-3521907-A1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION Mitsui Chemicals, Inc. (JP) 2019-08-07 EP disclosed
US-20190211258-A1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS, INC. (JP) 2019-07-11 US disclosed
CN-106604935-B Method for producing terminal-modified conjugated diene polymer, rubber composition, and tire 株式会社普利司通 2019-02-22 CN disclosed
US-20180341043-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL OBTAINED FROM THE COMPOSITION, AND PLASTIC LENS MITSUI CHEMICALS, INC. (JP) 2018-11-29 US disclosed
EP-3351564-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND OPTICAL MATERIAL AND PLASTIC LENS OBTAINED FROM COMPOSITION Mitsui Chemicals, Inc. (JP) 2018-07-25 EP disclosed
CN-106604935-A Method for producing terminal-modified conjugated diene polymer, rubber composition, and tire 株式会社普利司通 2017-04-26 CN disclosed
WO-2014027849-A1 POLYMERIZABLE COMPOSITION FOR EPOXY ACRYLIC OPTICAL MATERIAL, AND METHOD FOR PREPARING EPOXY ACRYLIC OPTICAL MATERIAL 주식회사 케이오씨솔루션 (KR) 2014-02-20 WO disclosed
US-20100160530-A1 RUBBER COMPOSITION CONTAINING MODIFIED POLYBUTADIENE RUBBER AND TIRE BRIDGESTRONE CORPORATION (JP) 2010-06-24 US disclosed
US-20090292043-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORPORATION (JP) 2009-11-26 US disclosed
EP-1975200-A1 RUBBER COMPOSITION CONTAINING MODIFIED POLYBUTADIENE RUBBER AND TIRE Bridgestone Corporation (JP) 2008-10-01 EP disclosed
EP-1873168-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES Bridgestone Corporation (JP) 2008-01-02 EP disclosed
CN-1229449-C Malic acid diester surfactant AIR PROD & CHEM (US) 2005-11-30 CN disclosed
US-6969738-B2 Malic acid diester surfactants AIR PRODUCTS AND CHEMICALS, INC. (US) 2005-11-29 US disclosed
US-20020103280-A1 Malic acid diester surfactants LASSILA KEVIN RODNEY (US) 2002-08-01 US disclosed
US-6369146-B1 AN AQUEOUS ORGANIC COATING COMPRISING A RESIN, SURFACTANT, WETTING AGENT, FLOW AND LEVELING AGENTS AND AN HYDROXY DIALKYL(C3-6) MALEATE; REDUCED EQUILIBRIUM AND DYNAMIC SURFACE TENSION; COATINGS; INKS; ADHESIVES; HERBICIDES AIR PRODUCTS AND CHEMICALS, INC. 2002-04-09 US disclosed
CN-1302833-A Malic acid diester surfactant AIR PROD & CHEM (US) 2001-07-11 CN disclosed
EP-1095988-A2 Malic acid diester surfactants AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-05-02 EP disclosed