SCHEMBL42177

SCHEMBL42177

CC(O)CC(O)C(C)C

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
SCHEMBL29876881 0.85 TSHR (0.47)
SCHEMBL1789330 0.85 ALDH1A1 (0.39)
SCHEMBL5505711 0.85 ALDH1A1 (0.39)
SCHEMBL12079309 0.85 ALDH1A1 (0.39)
SCHEMBL5509376 0.85 ALDH1A1 (0.39)
SCHEMBL15147846 0.81 ALDH1A1 (0.36)
SCHEMBL18526917 0.81 ALDH1A1 (0.36)
SCHEMBL11890306 0.79
SCHEMBL5510558 0.79 TSHR (0.41)
SCHEMBL11890301 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116515117-A Hyperbranched quaternary ammonium salt polyether amino silicone oil and preparation method thereof 佛山市顺德区德美瓦克有机硅有限公司 2023-08-01 CN claimed
CN-116284799-A Organosilicon elastomer prepolymer emulsion softener and preparation method and application thereof 深圳天鼎新材料有限公司 2023-06-23 CN claimed
CN-109180843-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2022-03-01 CN claimed
CN-110407963-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-09-21 CN claimed
CN-110407964-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-09-21 CN claimed
CN-112940262-A Preparation method of high-flash-point polyether epoxy silicone oil 佛山市顺德区德美瓦克有机硅有限公司 2021-06-11 CN claimed
CN-110407963-A Catalytic component and preparation method thereof for olefinic polymerization CHINA PETROLEUM & CHEM CORP 2019-11-05 CN claimed
CN-1110541-C Concentrated water-dispersible stable fiber softener compositions PROCTER & GAMBLE (US) 2003-06-04 CN claimed
CN-1098350-C Fabric softening compound/composition PROCTER & GAMBLE (US) 2003-01-08 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
CN-118414365-B Photocurable composition 斯特拉塔西斯公司 2025-05-16 CN disclosed
CN-116284799-B Organosilicon elastomer prepolymer emulsion softener and preparation method and application thereof 深圳天鼎新材料有限公司 2025-01-28 CN disclosed
EP-4430098-A1 PHOTO-CURABLE COMPOSITIONS Stratasys, Inc. (US) 2024-09-18 EP disclosed
WO-1997003170-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed
WO-1997003172-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed
US-4443360-A Oil-soluble zinc cyclic hydrocarbyl dithiophosphate-succinimide complex and lubricating oil compositions containing same CHEVRON RESEARCH COMPANY (US) 1984-04-17 US disclosed
US-4180673-A USED FOR TRANSFER TAPES IN PRODUCTION OF PRINTED CIRCUITS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1979-12-25 US disclosed