SCHEMBL947029

SCHEMBL947029

OCC(O)CCBr

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
SCHEMBL31672195 1.00
Acetone SCHEMBL9731677 0.87 THRB (0.43)
Acetone SCHEMBL9777640 0.87 THRB (0.43)
Formic Acid SCHEMBL10926943 0.87 THRB (0.43)
SCHEMBL7138282 0.82
SCHEMBL1141974 0.81
SCHEMBL28470555 0.79
SCHEMBL11913780 0.79 USP2 (0.41)
SCHEMBL7157355 0.78 THRB (0.71)
SCHEMBL10581335 0.78 THRB (0.71)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708799-B Cured product of organic phosphine modified unsaturated polyester and polyhalide and preparation method thereof 浙江工业大学 2025-05-30 CN claimed
CN-119842040-A Post-crosslinking controlled-release nitric oxide amphiphilic polyurethane and preparation method and application thereof 江苏鱼跃凯立特生物科技有限公司 2025-04-18 CN claimed
CN-116694143-B Coating composition with self-repairing characteristic for printing plate and preparation method thereof 安徽强邦新材料股份有限公司 2024-03-29 CN claimed
CN-117229475-B Polyurethane coating for textile fabric and preparation method thereof 河北皓普化工有限公司 2024-02-20 CN claimed
CN-117229475-A Polyurethane coating for textile fabric and preparation method thereof 河北皓普化工有限公司 2023-12-15 CN claimed
CN-116694143-A Coating composition with self-repairing characteristic for printing plate and preparation method thereof 安徽强邦新材料股份有限公司 2023-09-05 CN claimed
CN-112574384-A Thermoplastic polyurethane elastomer material and preparation method and application thereof 万华化学集团股份有限公司 2021-03-30 CN claimed
CN-119708799-B Cured product of organic phosphine modified unsaturated polyester and polyhalide and preparation method thereof 浙江工业大学 2025-05-30 CN disclosed
CN-119661826-B Cured product of phosphonium styryl-modified unsaturated polyester and preparation method thereof 浙江工业大学 2025-05-13 CN disclosed
CN-119842040-A Post-crosslinking controlled-release nitric oxide amphiphilic polyurethane and preparation method and application thereof 江苏鱼跃凯立特生物科技有限公司 2025-04-18 CN disclosed
CN-119708799-A Cured product of organic phosphine modified unsaturated polyester and polyhalide and preparation method thereof 浙江工业大学 2025-03-28 CN disclosed
CN-119708798-A Cured product of organic phosphine modified unsaturated polyester and epoxy resin and preparation method thereof 浙江工业大学 2025-03-28 CN disclosed
CN-119661826-A Cured product of phosphonium styryl-modified unsaturated polyester and preparation method thereof 浙江工业大学 2025-03-21 CN disclosed
EP-1518553-A2 Use of nitrate ester compounds for treating pain or providing analgesia QUEEN'S UNIVERSITY AT KINGSTON (CA) 2005-03-30 EP disclosed
EP-1246625-B1 USES AND COMPOSITIONS OF NITRATE ESTERS FOR PROVIDING SEDATION UNIV KINGSTON (CA) 2004-12-01 EP disclosed
EP-1246625-A2 METHODS AND COMPOSITIONS FOR MITIGATING PAIN USING NITRATE ESTERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2002-10-09 EP disclosed
WO-2001049275-A2 METHODS AND COMPOSITIONS FOR MITIGATING PAIN USING NITRATE ESTERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2001-07-12 WO disclosed
US-4515722-A Phosphatidyl inositol analogs useful as anti-inflammatory/analgesic agents MERCK & CO., INC. (US) 1985-05-07 US disclosed
US-4140606-A Process for preparing a polymerizable (meth) acrylate oligomer SHOWA DENKO K.K. (JP) 1979-02-20 US disclosed
US-3962438-A Anti-arthritic 1H-pyrimido-(5,4,3-kl)phenothiazine-1,3(2H)-diones and 1-thiones SMITHKLINE CORPORATION (US) 1976-06-08 US disclosed