SCHEMBL16761002

SCHEMBL16761002

CC(C)(O)O[PH](=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
SCHEMBL1687808 0.81
SCHEMBL31435879 0.79
SCHEMBL331834 0.78
SCHEMBL16761003 0.78 ALDH1A1 (0.30)
SCHEMBL17923493 0.77
Water SCHEMBL30726534 0.75
SCHEMBL29119800 0.75
Water SCHEMBL29119808 0.73 ALDH1A1 (0.30)
SCHEMBL17696695 0.73
SCHEMBL28244105 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285563-A Preparation method of dibutyl (1-hydroxy-1-methylethyl) phosphonate 浙江万盛股份有限公司 2023-12-26 CN claimed
CN-102549004-A Processes for production of cyclic alkylene phosphohalidate and cyclic phosphoric acid ester DAIHACHI CHEM IND 2012-07-04 CN claimed
CN-117285563-A Preparation method of dibutyl (1-hydroxy-1-methylethyl) phosphonate 浙江万盛股份有限公司 2023-12-26 CN disclosed
CN-117285563-A Preparation method of dibutyl (1-hydroxy-1-methylethyl) phosphonate 浙江万盛股份有限公司 2023-12-26 CN disclosed
CN-117285563-A Preparation method of dibutyl (1-hydroxy-1-methylethyl) phosphonate 浙江万盛股份有限公司 2023-12-26 CN disclosed
EP-2881198-B1 PROCESS FOR PRODUCING COATED FINE SILVER PARTICLES AND PASTE COMPRISING SAID COATED FINE SILVER PARTICLES UNIV YAMAGATA NAT UNIV CORP (JP) 2020-03-25 EP disclosed
US-20150231698-A1 PROCESS FOR PRODUCING COATED SILVER FINE PARTICLES AND COATED SILVER FINE PARTICLES PRODUCED BY SAID PRODUCTION PROCESS NATIONAL UNIVERSITY CORPORATION YAMAGATA UNIVERSITY (JP) 2015-08-20 US disclosed
EP-2881198-A1 PROCESS FOR PRODUCING COVERED SILVER FINE PARTICLES AND COVERED SILVER FINE PARTICLES PRODUCED BY SAID PROCESS National University Corporation Yamagata University (JP) 2015-06-10 EP disclosed
CN-102549004-A Processes for production of cyclic alkylene phosphohalidate and cyclic phosphoric acid ester DAIHACHI CHEM IND 2012-07-04 CN disclosed
CN-101044148-B Method for producing phosphonate having alcoholic hydroxy group DAIHACHI CHEM IND 2010-11-03 CN disclosed
CN-100577670-C Process for producing phosphorus compound having phosphate-phosphonate bond DAIHACHI CHEM IND 2010-01-06 CN disclosed
CN-101048420-A Method for producing phosphorus compound having phosphate-phosphonate bond DAIHACHI CHEM IND (JP) 2007-10-03 CN disclosed
CN-101044148-A Method for producing phosphonate having alcoholic hydroxy group DAIHACHI CHEM IND (JP) 2007-09-26 CN disclosed