SCHEMBL3859913

SCHEMBL3859913

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

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
SCHEMBL2966908 0.81
SCHEMBL8474559 0.81
SCHEMBL8726421 0.80 PTGS1 (0.37)
SCHEMBL8726425 0.80 PTGS1 (0.37)
SCHEMBL21714 0.78
SCHEMBL21716 0.78
SCHEMBL6573659 0.78
SCHEMBL345294 0.77 AKR1C3 (0.37)
SCHEMBL16245177 0.76
SCHEMBL1673409 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5213938-A Oxidation of toner compositions XEROX CORPORATION (US) 1993-05-25 US claimed
CN-110051686-A Composition comprising cross-linked cationic conjugated polymer 瑞立普萨公司 2019-07-26 CN disclosed
CN-105451746-A Compositions comprising crosslinked cationically binding polymers RELYPSA INC 2016-03-30 CN disclosed
US-8361663-B2 Porous carbon structure, method for preparing same, electrode catalyst for fuel cell, and electrode and membrane-electrode assembly including same SAMSUNG SDI CO., LTD. (KR) 2013-01-29 US disclosed
US-20090136808-A1 Porous carbon structure, method for preparing same, electrode catalyst for fuel cell, and electrode and membrane-electrode assembly including same SAMSUNG SDI CO., LTD., A CORPORATION CHARTERED IN AND EXISTING UNDER THE LAWS OF THE REPUBLIC OF KOREA (KR) 2009-05-28 US disclosed
US-6767979-B1 CROSSLINKED POLYMER OBTAINABLE BY RADICAL POLYMERIZATION OF ETHYLENICALLY UNSATURATED MONOMERS INCLUDING ZWITTERIONIC MONOMER, AROMATIC GROUP CONTAINING MONOMER, AND CROSSLINKING MONOMER; SWELLABLE IN WATER BIOCOMPATIBLES UK LIMITED (GB) 2004-07-27 US disclosed
EP-1141054-B1 CROSSLINKED POLYMERS AND REFRACTIVE DEVICES FORMED THEREFROM BIOCOMPATIBLES UK LTD (GB) 2004-02-25 EP disclosed
EP-1141054-A1 CROSSLINKED POLYMERS AND REFRACTIVE DEVICES FORMED THEREFROM BIOCOMPATIBLES LTD. (GB) 2001-10-10 EP disclosed
WO-2000035980-A1 CROSSLINKED POLYMERS AND REFRACTIVE DEVICES FORMED THEREFROM BIOCOMPATIBLES LIMITED (GB) 2000-06-22 WO disclosed
US-5928832-A Toner adsorption processes XEROX CORPORATION (US) 1999-07-27 US disclosed
US-5213938-A Oxidation of toner compositions XEROX CORPORATION (US) 1993-05-25 US disclosed
EP-0470834-A2 Photosensitive flexographic printing plate composition HAYAKAWA RUBBER COMPANY LIMITED (JP) 1992-02-12 EP disclosed