SCHEMBL125829

SCHEMBL125829

C[C](O)C1CCCC1

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
SCHEMBL127438 0.97
SCHEMBL128883 0.93
SCHEMBL131270 0.85
SCHEMBL3881584 0.74 CES2 (0.42)
SCHEMBL269368 0.74
SCHEMBL24790711 0.73 CES2 (0.36)
SCHEMBL5281 0.71
SCHEMBL1858120 0.71 CES2 (0.47)
SCHEMBL5131 0.71 CES2 (0.47)
SCHEMBL6272207 0.71 CES2 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102875704-B Olefin polymerization catalyst, preparation method and application thereof PETROCHINA CO LTD 2015-04-08 CN claimed
CN-102558403-B Glycol ether polyolefin catalyst and preparation and application thereof PETROCHINA CO LTD 2014-08-06 CN claimed
CN-102875704-A Olefin polymerization catalyst, preparation method and application thereof PETROCHINA CO LTD 2013-01-16 CN claimed
CN-102558403-A Glycol ether polyolefin catalyst and preparation and application thereof PETROCHINA CO LTD 2012-07-11 CN claimed
CN-102875704-B Olefin polymerization catalyst, preparation method and application thereof PETROCHINA CO LTD 2015-04-08 CN disclosed
CN-102492061-B Alkene polymerization catalyst, preparation method thereof, and application thereof UNIV BEIJING CHEMICAL 2014-08-20 CN disclosed
CN-102558403-B Glycol ether polyolefin catalyst and preparation and application thereof PETROCHINA CO LTD 2014-08-06 CN disclosed
US-8450319-B2 Pyrrolopyridazinone compound UBE INDUSTRIES, LTD. (JP) 2013-05-28 US disclosed
CN-102875704-A Olefin polymerization catalyst, preparation method and application thereof PETROCHINA CO LTD 2013-01-16 CN disclosed
CN-101374844-B Pyrrolopyridazinone compound UBE INDUSTRIES 2012-10-24 CN disclosed
CN-102558403-A Glycol ether polyolefin catalyst and preparation and application thereof PETROCHINA CO LTD 2012-07-11 CN disclosed
CN-102492061-A Alkene polymerization catalyst, preparation method thereof, and application thereof UNIV BEIJING CHEMICAL 2012-06-13 CN disclosed
CN-101374844-A Pyrrolopyridazinone compound UBE INDUSTRIES (JP) 2009-02-25 CN disclosed
US-20090036453-A1 Pyrrolopyridazinone Compound UBE INDUSTRIES, LTD. (JP) 2009-02-05 US disclosed
EP-1982986-A1 PYRROLOPYRIDAZINONE COMPOUND Ube Industries, Ltd. (JP) 2008-10-22 EP disclosed
US-7071359-B1 Neuropathy improvers containing nitrogenous compounds as the active ingredient TEIJIN LIMITED (JP) 2006-07-04 US disclosed
EP-1201235-B1 NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT TEIJIN LTD (JP) 2005-10-12 EP disclosed
CN-1377263-A Neuropathy improves containing nitrogenous compounds as the active ingredient TEIJIN LTD (JP) 2002-10-30 CN disclosed
EP-1201235-A1 NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT TEIJIN LIMITED (JP) 2002-05-02 EP disclosed
CN-1078234-A Pyrazole carboxanilide fungicide MONSANTO CO (US) 1993-11-10 CN disclosed