SCHEMBL2184399

SCHEMBL2184399

O=C(OCCC1CCCCC1)c1cccc(C(=O)OCCC2CCCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
HDAC6 Q9UBN7 1/20 0.46
CHRM2 P08172 2/20 0.46
CHRM4 P08173 2/20 0.46
CHRM5 P08912 2/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPM1D O15297 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CASR P41180 1/20 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
SCHEMBL28803760 0.89 TDP1 (0.56) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL250654 0.87 KMT2A (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6837846 0.87 SMN1; SMN2 (0.46) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL3423895 0.85 KMT2A (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL12019830 0.83 CHRM2 (0.40) HDAC6CHRM2CHRM4CHRM5CHRM1
SCHEMBL107374 0.83 L3MBTL1 (0.43) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL14883128 0.82 HTR7 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2696573 0.81 CHRM1 (0.43) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1020868 0.81 ALDH1A1 (0.51) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL17683885 0.81 CHRM2 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370494-B1 PROCESS FOR THE MANUFACTURE OF POLYCYCLOHEXANE DIMETHYLENE TEREPHTHALATE COPOLYMERS FROM POLYETHYLENE TEREPHTHALATE, AND COMPOSITIONS AND ARTICLES THEREOF SABIC INNOVATIVE PLASTICS IP (NL) 2014-09-10 EP claimed
EP-2447298-A1 Process for the manufacture of polycyclohexane, dimethylene, terephthalate copolymers from polyethylene terephthalate and compositions and articles thereof SABIC Innovative Plastics B.V. (NL) 2012-05-02 EP claimed
EP-2370494-A2 PROCESS FOR THE MANUFACTURE OF POLYCYCLOHEXANE DIMETHYLENE TEREPHTHALATE COPOLYMERS FROM POLYETHYLENE TEREPHTHALATE, AND COMPOSITIONS AND ARTICLES THEREOF SABIC Innovative Plastics IP B.V. (NL) 2011-10-05 EP claimed
US-20110165214-A1 Use of a plastic composition and a product obtained thereby POLYGIENE AB (SE) 2011-07-07 US claimed
WO-2010078141-A2 PROCESS FOR THE MANUFACTURE OF POLYCYCLOHEXANE DIMETHYLENE TEREPHTHALATE COPOLYMERS FROM POLYETHYLENE TEREPHTHALATE, AND COMPOSITIONS AND ARTICLES THEREOF SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-07-08 WO claimed
US-20100168328-A1 PROCESS FOR THE MANUFACTURE OF POLYCYCLOHEXANE DIMETHYLENE TEREPHTHALATE COPOLYMERS FROM POLYETHYLENE TEREPHTHALATE, AND COMPOSITIONS AND ARTICLES THEREOF SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-07-01 US claimed
WO-2010030216-A1 ACETYLENIC POLY(ALKYLENE PHTHALATE) NEXAM CHEMICAL AB (SE) 2010-03-18 WO claimed
EP-3970942-B1 COMPOSITE MOLDED ARTICLE TORAY INDUSTRIES (JP) 2024-03-27 EP disclosed
US-11578185-B2 Polyester resin composition, molded article, and composite molded article TORAY INDUSTRIES, INC. (JP) 2023-02-14 US disclosed
US-20220145044-A1 POLYESTER RESIN COMPOSITION, MOLDED ARTICLE, AND COMPOSITE MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2022-05-12 US disclosed
US-10040910-B2 Polyphenylene sulfide block copolymer, method for manufacturing same, and method for manufacturing polyphenylene sulfide porous body TORAY INDUSTRIES, INC. (JP) 2018-08-07 US disclosed
US-20160319082-A1 Polyphenylene Sulfide Block Copolymer, Method for Manufacturing Same, and Method for Manufacturing Polyphenylene Sulfide Porous Body TORAY INDUSTRIES, INC. (JP) 2016-11-03 US disclosed
EP-3088443-A1 POLYPHENYLENE SULPHIDE BLOCK COPOLYMER, METHOD FOR MANUFACTURING SAME, AND METHOD FOR MANUFACTURING POLYPHENYLENE SULPHIDE POROUS BODY Toray Industries, Inc. (JP) 2016-11-02 EP disclosed
US-20090275678-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF TORAY INDUSTRIES, INC. (JP) 2009-11-05 US disclosed
EP-2036952-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE THEREOF Toray Industries, Inc. (JP) 2009-03-18 EP disclosed
EP-0288972-B1 GAS-BARRIER MULTILAYERED STRUCTURE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-09-15 EP disclosed
US-5106693-A Comprising polyamides, polycarbonates, polyolefins and polyesters; bottles, sheets, films MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1992-04-21 US disclosed
EP-0318964-B1 TRANSPARENT GAS-BARRIER MULTILAYER STRUCTURE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1992-03-18 EP disclosed
US-4908272-A Amorphous copolyamide layer, thermoplastic resin layer MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1990-03-13 US disclosed
EP-0318964-A2 Transparent gas-barrier multilayer structure MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-06-07 EP disclosed