SCHEMBL528947

SCHEMBL528947

C=C(CC(=O)OC1CCCCC1)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.46
EPHX1 P07099 2/20 0.46
HTT P42858 2/20 0.42
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 6/20 0.39
TSHR P16473 3/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 1/20 0.39
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP19A1 P11511 2/20 0.37
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 2/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
MGAM O43451 1/20 0.34

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
SCHEMBL6520860 0.91 NAAA (0.42) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6522375 0.88 NAAA (0.42) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6523837 0.86 CYP2C19 (0.41) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6519192 0.86 CYP2C19 (0.41) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6518898 0.85 NAAA (0.42) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL21266113 0.85 NAAA (0.46) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL22615477 0.85 NAAA (0.46) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL17073950 0.85 CYP2C19 (0.46) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL481509 0.85 CYP2C19 (0.46) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL1993737 0.85 CYP2C19 (0.46) NAAAEPHX1HTTCYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4255945-A1 ADHESIVE TWO-COMPONENT COMPOSITION BASED ON ITACONATE MONOMER Bostik SA (FR) 2023-10-11 EP claimed
WO-2022117940-A1 ADHESIVE TWO-COMPONENT COMPOSITION BASED ON ITACONATE MONOMER BOSTIK SA (FR) 2022-06-09 WO claimed
EP-4112676-B1 METHOD FOR PRODUCING NITRILE RUBBER ZEON CORP (JP) 2026-02-18 EP disclosed
EP-3904430-B1 METHOD FOR RECYCLING NITRILE RUBBER ZEON CORP (JP) 2025-12-03 EP disclosed
EP-3916021-B1 METHOD FOR PRODUCING CARBOXYL GROUP-CONTAINING LIQUID NITRILE RUBBER ZEON CORP (JP) 2025-11-26 EP disclosed
US-12479947-B2 Curable compositions useful for obtaining non-sensitizing cured products ARKEMA FRANCE (FR) 2025-11-25 US disclosed
US-12404350-B2 Method for producing nitrile rubber ZEON CORPORATION (JP) 2025-09-02 US disclosed
US-12351716-B2 Method for recycling nitrile rubber ZEON CORPORATION (JP) 2025-07-08 US disclosed
US-12331197-B2 Power transmission belt DAYCO EUROPE S.R.L. (IT) 2025-06-17 US disclosed
EP-3404056-B1 METHOD FOR PRODUCING THERMOPLASTIC ELASTOMER COMPOSITION ZEON CORP (JP) 2025-06-11 EP disclosed
US-12202923-B2 Nitrile-group-containing copolymer rubber ZEON CORPORATION (JP) 2025-01-21 US disclosed
WO-2012013697-A2 HYDROGENATION OF DIENE-BASED POLYMERS LANXESS DEUTSCHLAND GMBH (DE) 2012-02-02 WO disclosed
WO-2011117194-A1 PROCESS FOR THE PRODUCTION OF WATER AND SOLVENT-FREE NITRILE RUBBERS LANXESS DEUTSCHLAND GMBH (DE) 2011-09-29 WO disclosed
EP-2368916-A1 Process for the production of water and solvent-free nitrile rubbers LANXESS International SA (CH) 2011-09-28 EP disclosed
EP-2009050-B1 CROSSLINKABLE NITRILE RUBBER COMPOSITION AND CROSSLINKED RUBBER PRODUCT ZEON CORP (JP) 2011-08-31 EP disclosed
US-20110190441-A1 NITRILE RUBBERS LANXESS DEUTSCHLAND GMBH (DE) 2011-08-04 US disclosed
US-20100168302-A1 Crosslinkable Rubber Composition and Cross-Linked Rubber ZEON CORPORATION (JP) 2010-07-01 US disclosed
US-20090186977-A1 Cross-Linkable Nitrile Rubber Composition and Cross-Linked Rubber ZEON CORPORATION (JP) 2009-07-23 US disclosed
EP-2009050-A1 CROSSLINKABLE NITRILE RUBBER COMPOSITION AND CROSSLINKED RUBBER PRODUCT ZEON CORPORATION (JP) 2008-12-31 EP disclosed
EP-1964882-A1 CROSSLINKABLE RUBBER COMPOSITION AND RUBBER CROSSLINKED PRODUCT ZEON CORPORATION (JP) 2008-09-03 EP disclosed