SCHEMBL4797583

SCHEMBL4797583

C=C(C)C(=O)OC.C=C(CC(CC)CCCC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 6/20 0.39
CA2 P00918 5/20 0.38
CA1 P00915 1/20 0.38
CYP3A4 P08684 4/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RECQL P46063 1/20 0.35
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
MMP14 P50281 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
Acrylic Acid Ethyl Ester SCHEMBL17888695 0.88 TSHR (0.51) ALDH1A1TSHRCA2CA1CYP3A4
Methacrylic Acid SCHEMBL9065134 0.88 CA2 (0.43) ALDH1A1TSHRCA2CA1CYP3A4
Styrene SCHEMBL2297805 0.86 ALDH1A1 (0.39) ALDH1A1TSHRCA2CYP3A4TDP1
SCHEMBL20609791 0.86 CA2 (0.47) ALDH1A1TSHRCA2CA1CYP3A4
SCHEMBL22081 0.86 CA2 (0.47) ALDH1A1TSHRCA2CA1CYP3A4
SCHEMBL29085127 0.86 TSHR (0.50) ALDH1A1TSHRCA2CYP3A4ATM
SCHEMBL20578185 0.85 TSHR (0.45) ALDH1A1TSHRCA2CA1CYP3A4
Ethylene SCHEMBL1759446 0.85 CA2 (0.46) ALDH1A1TSHRCA2CA1CYP3A4
Methacrylic Acid SCHEMBL1172436 0.84 ALDH1A1 (0.40) ALDH1A1TSHRCA2CYP3A4TDP1
SCHEMBL1079631 0.83 TSHR (0.34) ALDH1A1TSHRCA2CA1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117244406-A High-toughness polyvinyl chloride ultrafiltration membrane and preparation method thereof 海南立昇净水科技实业有限公司 2023-12-19 CN claimed
US-4073828-A THICKENING, GELLING ICI AMERICAS INC. (US) 1978-02-14 US claimed
US-20150064401-A1 GAS BARRIER FILM AND ELECTRONIC DEVICE Konica Minolta, Inc. (JP) 2015-03-05 US disclosed
US-20080315145-A1 FLUID CONTROL VALVE DEVICE AISAN KOGYO KABUSHIKI KAISHA (JP) 2008-12-25 US disclosed
US-7380499-B2 Image recording apparatus and printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-06-03 US disclosed
US-7147988-B2 A plastic support with a hydrophilic layer and back layer containing a matting agent with particle sizes between 3 and 9 microns; lithographic printing KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2006-12-12 US disclosed
US-20050221223-A1 A plastic support with a hydrophilic layer and back layer containing a matting agent with particle sizes between 3 and 9 microns; lithographic printing KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2005-10-06 US disclosed
EP-1582375-A1 Printing plate material, roll of a printing plate material and printing method Konica Minolta Medical & Graphic Inc. (JP) 2005-10-05 EP disclosed
US-20050139106-A1 Image recording apparatus KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2005-06-30 US disclosed
EP-1547802-A2 Image recording apparatus Konica Minolta Medical & Graphic, Inc. (JP) 2005-06-29 EP disclosed