SCHEMBL825422

SCHEMBL825422

CCC(C)(O)C(C)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
Acetic Acid SCHEMBL16320894 0.87 TP53 (0.33)
SCHEMBL7936457 0.83 TDP1 (0.32)
SCHEMBL13354747 0.78
SCHEMBL1490142 0.78
SCHEMBL13312865 0.78
SCHEMBL22300 0.78
SCHEMBL15373133 0.77
SCHEMBL8529153 0.77 TSHR (0.39)
SCHEMBL5907174 0.77 TSHR (0.33)
SCHEMBL5586390 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP claimed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP claimed
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2024-02-15 US claimed
CN-116490160-A A mixture containing 1, 2-alkanediol 西姆莱斯股份公司 2023-07-25 CN claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
WO-2021125050-A1 METHODS FOR PRODUCING COMPOUND HAVING PYRIDINE RING STRUCTURE AND COMPOUND HAVING PYRROLE RING STRUCTURE 旭化成株式会社 2021-06-24 WO claimed
CN-109135551-B High-flexibility water-based UV coating 深圳市前海奇迹新材料有限公司 2020-11-20 CN claimed
CN-109456693-A A kind of bloom wood paint 湖州吉复新型材料科技有限公司 2019-03-12 CN claimed
CN-109183050-A A kind of high-efficient rust-removing agent 湖州富美材料科技有限公司 2019-01-11 CN claimed
CN-100412147-C Cation resin composition KANSAI PAINT CO LTD (JP) 2008-08-20 CN claimed
US-6761973-B2 CATIONIC RESIN AND A POLYISOCYANATE BLOCKED WITH A BLOCKING AGENT CONTAINING A SPECIFIC DIOL KANSAI PAINT CO., LTD. (JP) 2004-07-13 US claimed
US-20030158348-A1 Cationic resin composition KANSAI PAINT CO., LTD. (JP) 2003-08-21 US claimed
CN-1110541-C Concentrated water-dispersible stable fiber softener compositions PROCTER & GAMBLE (US) 2003-06-04 CN claimed
CN-1408802-A Cation resin composition KANSAI PAINT CO LTD (JP) 2003-04-09 CN claimed
CN-1244212-A Improved expression vectors PROCTER & GAMBLE (US) 2000-02-09 CN claimed
CN-1219953-A Fabric softening compound/composition PROCTER & GAMBLE (US) 1999-06-16 CN claimed
CN-1196081-A Concentrated, water dispersible, stable, fabric softening compositions PROCTER & GAMBLE (US) 1998-10-14 CN claimed
CN-1195369-A Concentrated and stable fabric softening compositions PROCTER & GAMBLE (US) 1998-10-07 CN claimed
US-4599463-A Process for the preparation of bisphenols GENERAL ELECTRIC COMPANY (US) 1986-07-08 US claimed