SCHEMBL463271

SCHEMBL463271

[CH2]CC(O)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
Ethylene SCHEMBL7110185 0.97
SCHEMBL1006756 0.97
Ethylene SCHEMBL7532102 0.97 OR51E2 (0.50)
SCHEMBL10697487 0.75
SCHEMBL8946177 0.72
SCHEMBL19331462 0.72 OR51E2 (0.59)
SCHEMBL6054264 0.72 TET2 (0.67)
SCHEMBL3261082 0.72 TET2 (0.67)
SCHEMBL728172 0.72 OR51E2 (0.59)
SCHEMBL7856245 0.72 OR51E2 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150336926-A1 FLUORINATION OF ARYL COMPOUNDS NIH 2015-11-26 US claimed
EP-1250914-B2 Cooling compositions PROCTER & GAMBLE (US) 2015-11-25 EP claimed
EP-1950294-B1 NOVEL CELL PENETRATING PEPTIDE MITSUBISHI TANABE PHARMA CORP (JP) 2012-01-18 EP claimed
US-8044019-B2 Cell penetrating peptide MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-25 US claimed
CN-1501816-B An absorbent article comprising an agent able to convey a perception to the wearer PROCTER & GAMBLE 2010-05-26 CN claimed
US-20100048487-A1 NOVEL CELL PENETRATING PEPTIDE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-02-25 US claimed
EP-1250940-B1 An absorbent article comprising an agent able to convey a perception to the wearer PROCTER & GAMBLE (US) 2010-01-06 EP claimed
CN-100540063-C Articles comprising mint odor-free cooling agents P & G CO (US) 2009-09-16 CN claimed
CN-100441158-C Cooling composition PROCTER & GAMBLE (US) 2008-12-10 CN claimed
US-20080267869-A1 RADIOACTIVE TRANSITION METAL-IMIDO HETERO-DIPHOSPHINE COMPLEXES, THEIR PREPARATION AND RADIOPHARMACEUTICAL COMPOSITIONS THEREOF BRACCO IMAGING S.P.A. (IT) 2008-10-30 US claimed
EP-1474400-A1 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)] -6-HYDROXYBIPHENYL-3-YL DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-11-10 EP claimed
EP-1417977-A1 Radioactive transition metal-imido hetero-diphosphine complexes, their preparation and radiopharmaceutical compositions thereof BRACCO IMAGING S.p.A. (IT) 2004-05-12 EP claimed
WO-2003068756-A1 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)]-6-HYDROXYBIPHENYL-3-YL DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-08-21 WO claimed
EP-0673916-B1 Preparation of 2,2,4-trimethyl-1,3-pentanediol dibenzoate and di(alkyl-substituted) benzoates VELSICOL CHEMICAL CORP (US) 1998-01-07 EP claimed
EP-0416822-B1 Stain-resistant plasticizer compositions and method of making same VELSICOL CHEMICAL CORP (US) 1996-03-13 EP claimed
EP-0673916-A1 Preparation of 2,2,4-trimethyl-1,3-pentanediol dibenzoate and di(alkyl-substituted) benzoates VELSICOL CHEMICAL CORPORATION (US) 1995-09-27 EP claimed
US-5153342-A Esterification of 2,2,4-trimethyl-1,3-pentanediol with (alkyl) benzoic acids using basic catalysts HULS AMERICA INC. (US) 1992-10-06 US claimed
EP-0416822-A2 Stain-resistant plasticizer compositions and method of making same VELSICOL CHEMICAL CORPORATION (US) 1991-03-13 EP claimed
EP-0205403-B1 PROCESS FOR THE MANUFACTURE OF CYCLOPROPYLAMINE CIBA-GEIGY AG (CH) 1989-08-30 EP claimed
US-4208527-A MULTISTAGE, MULTIZONAL, POLYMERIZATION CATALYST, DICOLORATION INHIBITION CHEMISCHE WERKE HULS, AKTIENGESELLSCHAFT (DE) 1980-06-17 US claimed