SCHEMBL3138396

SCHEMBL3138396

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

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
SCHEMBL13184581 0.82
Hexylene Glycol SCHEMBL5655718 0.81 LMNA (0.45)
SCHEMBL5606568 0.81 ACACB (0.42)
SCHEMBL25190937 0.81 USP2 (0.42)
Methacrylic Acid SCHEMBL22346063 0.81 TET2 (0.42)
Hexylene Glycol SCHEMBL10377799 0.79 TDP1 (0.48)
SCHEMBL414699 0.79
SCHEMBL11890981 0.79
SCHEMBL11890983 0.79
SCHEMBL17467771 0.78 LMNA (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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120005137-A Microcapsule closed type polybasic isocyanate, medium, grating and preparation method and equipment 珠海莫界科技有限公司 2025-05-16 CN claimed
CN-118240233-A Functionalized polymer grafted functionalized nano material composite modifier, modified asphalt and application thereof in coating waterproofing 苏州非特兄弟新材料科技有限公司 2024-06-25 CN claimed
CN-118063784-A Nano material grafted block copolymer composite modified asphalt and waterproof application 苏州非特兄弟新材料科技有限公司 2024-05-24 CN claimed
CN-116549423-A Resveratrol dihydric alcohol plastid and preparation method and application thereof 浙江中医药大学 2023-08-08 CN claimed
EP-0218441-B1 COSMETIC COMPOSITION LION CORPORATION (JP) 1990-04-25 EP claimed
US-4793336-A INSOLUBILIZING DEXTRAN WITH EPICHLOROHYDRIN, IMPREGNATING WITH HUMECTANT MIXTURE WANG PAUL Y (CA) 1988-12-27 US claimed
CN-120005137-A Microcapsule closed type polybasic isocyanate, medium, grating and preparation method and equipment 珠海莫界科技有限公司 2025-05-16 CN disclosed
US-20250090500-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS LOXO ONCOLOGY, INC. 2025-03-20 US disclosed
CN-114605327-B Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2025-03-11 CN disclosed
CN-114716381-B Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2025-03-11 CN disclosed
CN-114573510-B Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2025-02-25 CN disclosed
US-12220401-B2 Compounds useful as kinase inhibitors LOXO ONCOLOGY, INC. (US) 2025-02-11 US disclosed
CN-114591242-B Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2025-01-07 CN disclosed
US-5340884-A Polyamide concentrate useful for producing blends having improved flavor retaining property and clarity EASTMAN KODAK COMPANY (US) 1994-08-23 US disclosed
US-5258233-A Gas barrier; improved food storage EASTMAN KODAK COMPANY (US) 1993-11-02 US disclosed
WO-1993020147-A1 POLYESTER/POLYAMIDE BLEND HAVING IMPROVED FLAVOR RETAINING PROPERTY AND CLARITY EASTMAN CHEMICAL COMPANY (US) 1993-10-14 WO disclosed
US-4793336-A INSOLUBILIZING DEXTRAN WITH EPICHLOROHYDRIN, IMPREGNATING WITH HUMECTANT MIXTURE WANG PAUL Y (CA) 1988-12-27 US disclosed
US-4793336-A INSOLUBILIZING DEXTRAN WITH EPICHLOROHYDRIN, IMPREGNATING WITH HUMECTANT MIXTURE WANG PAUL Y (CA) 1988-12-27 US disclosed
US-4643179-A EPICHLOROHYDRIN INSOLUBILIZED DEXTRAN, HUMECTANTS, ANTIMICROBIAL COMPONENT WANG PAUL Y (CA) 1987-02-17 US disclosed
US-4643179-A EPICHLOROHYDRIN INSOLUBILIZED DEXTRAN, HUMECTANTS, ANTIMICROBIAL COMPONENT WANG PAUL Y (CA) 1987-02-17 US disclosed