SCHEMBL987648

SCHEMBL987648

C=CCOC(=O)C1CCCCC1C(=O)OCC=C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
TP53 P04637 2/20 0.48
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
TSHR P16473 4/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL1220674 0.93 TP53 (0.43) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL29108682 0.91 ALDH1A1 (0.42) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL9769692 0.91 CYP3A4 (0.42) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL27351320 0.89 PEPD (0.42) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL3290514 0.87 EPHX1 (0.44) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL423861 0.86 TSHR (0.38) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL1326038 0.86 TSHR (0.38) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL9285637 0.86 CYP3A4 (0.41) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL9285973 0.86 CYP3A4 (0.41) CYP3A4TP53ALDH1A1GAATSHR
SCHEMBL7642516 0.85 TP53 (0.76) CYP3A4TP53ALDH1A1GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025078827-A1 PRINTING INK FUJIFILM SPECIALITY INK SYSTEMS LIMITED (GB) 2025-04-17 WO claimed
EP-3199562-B1 PHOTOCURABLE RESIN COMPOSITION, INK AND COATING MATERIAL OSAKA SODA CO LTD (JP) 2024-04-03 EP claimed
CN-115812073-A Production and use of plasticizers based on the 2, 4-isomer of furan dicarboxylic acid diesters 布拉斯科有限公司 2023-03-17 CN claimed
US-9534104-B2 Plasticizer blends and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-01-03 US claimed
US-9403925-B2 Curable composition and cured article ADEKA CORPORATION (JP) 2016-08-02 US claimed
WO-2015112285-A1 PLASTICIZER BLENDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-07-30 WO claimed
US-20140315021-A1 Plasticizer Blends and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2014-10-23 US claimed
US-20110021694-A1 POLYESTERURETHANE FOR COATING COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-01-27 US claimed
EP-0233299-B1 OPTICAL RESIN AND PROCESS FOR PREPARING THE SAME NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 EP claimed
US-4855374-A Optical resin from diallyl esters NIPPON OIL AND FATS CO., LTD. (JP) 1989-08-08 US claimed
EP-0233299-A1 Optical resin and process for preparing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-08-26 EP claimed
US-4562274-A REACTING POLYALLYL COMPOUNDS WITH PERCARBOXYLIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1985-12-31 US claimed
JP-7033830-A None JP disclosed
JP-60031529-A None JP disclosed
JP-7070260-A None JP disclosed
JP-6073145-A None JP disclosed
EP-0008111-B1 PROCESS FOR THE PREPARATION OF GLYCIDYL ESTERS OF CYCLOALIPHATIC POLYCARBOXYLIC ACIDS BAYER AG (DE) 1983-01-26 EP disclosed
JP-S5753517-A ELECTRICAL INSULATING COMPOSITION TOSHIBA CORP 1982-03-30 JP disclosed
EP-0008111-A1 Process for the preparation of glycidyl esters of cycloaliphatic polycarboxylic acids BAYER AG (DE) 1980-02-20 EP disclosed
JP-S0631529-A 0001-01-01 JP disclosed