SCHEMBL3439196

SCHEMBL3439196

CC=C(F)C(=O)OCC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL265509 1.00
Pentachlorophenol SCHEMBL10921533 0.83 GPR35 (0.37)
SCHEMBL8121882 0.83
SCHEMBL12743046 0.83
SCHEMBL8121880 0.83
SCHEMBL24461710 0.82 ALDH1A1 (0.44)
SCHEMBL30558699 0.81
SCHEMBL29194429 0.81 NPSR1 (0.43)
SCHEMBL29832048 0.81 NPSR1 (0.43)
SCHEMBL27499186 0.81 NPSR1 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112533897-B Halogenated allylamine sulfone derivative inhibitors of lysyl oxidase and uses thereof 法玛西斯有限公司 2023-07-14 CN disclosed
CN-114286816-A Difluoro-halogenated allylamine sulfone derivative inhibitor of lysyl oxidase, preparation method and application thereof 法玛西斯有限公司 2022-04-05 CN disclosed
US-20150196585-A1 COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS AND USES THEREOF VIFOR (INTERNATIONAL) LTD. (CH) 2015-07-16 US disclosed
US-20150183908-A1 COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS AND USES THEREOF VIFOR (INTERNATIONAL) LTD. (CH) 2015-07-02 US disclosed
EP-2874633-A1 COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS Relypsa, Inc. (US) 2015-05-27 EP disclosed
WO-2014015240-A1 COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS SORBENT THERAPEUTICS, INC. (US) 2014-01-23 WO disclosed
WO-2014015244-A1 COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS SORBENT THERAPEUTICS, INC. (US) 2014-01-23 WO disclosed
US-7807658-B2 Use of GabaB receptor agonists ASTRAZENECA AB (SE) 2010-10-05 US disclosed
US-20080146836-A1 New Aminopropylphosphinic acids ELEBRING THOMAS 2008-06-19 US disclosed
US-20070021393-A1 New use of GabaB receptor agonists LEHMANN ANDERS 2007-01-25 US disclosed
US-20020156053-A1 New aminopropylphosphinic acids GENERAL ELECTRIC CAPITAL CORPORATION, AS AGENT 2002-10-24 US disclosed
EP-1239843-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS AstraZeneca AB (SE) 2002-09-18 EP disclosed
WO-2001041743-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS ASTRAZENECA AB (SE) 2001-06-14 WO disclosed
CN-1187816-A Process for preparing substituted aryluracils BAYER AG (DE) 1998-07-15 CN disclosed
US-5459149-A Penta-2,4-dienamides and use as pesticides ROUSSEL UCLAF (FR) 1995-10-17 US disclosed
US-5270343-A Penta-2,4-dienamides and use as pesticides ROUSSEL UCLAF (FR) 1993-12-14 US disclosed
EP-0202500-B1 NOVEL CARBOXYLIC ACID ESTERS, METHODS FOR PRODUCTION THEREOF AND INSECTICIDES CONTAINING THEM AS THE ACTIVE INGREDIENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-02-22 EP disclosed
US-4774369-A ALCOHOLS AS INTERMEDIATES FOR INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-27 US disclosed
US-4714712-A Carboxylic acid esters and insecticides containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-12-22 US disclosed
EP-0202500-A1 Novel carboxylic acid esters, methods for production thereof and insecticides containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-11-26 EP disclosed