SCHEMBL516539

SCHEMBL516539

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

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 3/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL28872748 0.97 MAPK1 (0.38) MAPK1ALDH1A1
SCHEMBL13672646 0.75 MAPK1 (0.36) MAPK1ALDH1A1
SCHEMBL6673656 0.75 TSHR (0.43) ALDH1A1
SCHEMBL7812132 0.75 MAPK1 (0.32) MAPK1
SCHEMBL7051974 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9329687 0.72 ALDH1A1 (0.44) ALDH1A1
SCHEMBL754497 0.72 MAPK1 (0.36) MAPK1ALDH1A1
SCHEMBL12433234 0.72 MAPK1 (0.36) MAPK1ALDH1A1
SCHEMBL823099 0.72 CYP2C19 (0.38) MAPK1ALDH1A1
SCHEMBL23126606 0.71 MAPK1 (0.33) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107001213-B Preparation method and purification method of organic compound with fluorinated aliphatic group 财团法人峨山社会福祉财团 2021-01-15 CN claimed
EP-3216780-B1 METHOD FOR PREPARING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AND METHOD FOR PURIFYING ORGANIC FLUORIDE-ALIPHATIC COMPOUND ASAN FOUND (KR) 2020-10-07 EP claimed
CN-111574515-A Preparation method and purification method of organic fluorinated aliphatic compound 财团法人峨山社会福祉财团 2020-08-25 CN claimed
US-20170319720-A1 METHOD FOR PREPARING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AND METHOD FOR PURIFYING ORGANIC FLUORIDE-ALIPHATIC COMPOUND Ackerman, Christopher (PR) 2017-11-09 US claimed
EP-3216780-A1 METHOD FOR PREPARING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AND METHOD FOR PURIFYING ORGANIC FLUORIDE-ALIPHATIC COMPOUND The Asan Foundation (KR) 2017-09-13 EP claimed
CN-107001213-A Preparation method and purification method of organic fluorinated aliphatic compound 财团法人峨山社会福祉财团 2017-08-01 CN claimed
CN-119998260-A Process for preparing amides from esters 巴斯夫欧洲公司 2025-05-13 CN disclosed
CN-111801313-B Method for preparing polymorphic form B of treprostinil diethanolamine salt 奇诺因药物和化学工厂私人有限公司 2023-08-29 CN disclosed
US-20230219956-A1 QUINAZOLINE COMPOUND AND PHARMACEUTICAL APPLICATION THEREOF BETTA PHARMACEUTICALS CO.,LTD (CN) 2023-07-13 US disclosed
US-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS INCORPORATED 2023-05-25 US disclosed
CN-111574515-B Preparation method and purification method of organic fluorinated aliphatic compound 财团法人峨山社会福祉财团 2023-01-10 CN disclosed
EP-3521247-B1 FLAKE-LIKE MESOPOROUS PARTICLES AND MANUFACTURING METHOD THEREFOR NIPPON SHEET GLASS CO LTD (JP) 2022-01-26 EP disclosed
CN-107001213-B Preparation method and purification method of organic compound with fluorinated aliphatic group 财团法人峨山社会福祉财团 2021-01-15 CN disclosed
EP-0920430-B1 PURINE DERIVATIVES AND THEIR USE AS ANTI-COAGULANTS SCHERING AG (DE) 2003-09-24 EP disclosed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US disclosed
US-20020131932-A1 Radiopharmaceuticals for diagnosing alzheimer's disease SCHERING AG (DE) 2002-09-19 US disclosed
US-6313060-B1 Catalyst for ring-opening polymerization of alkylene oxide, method for preparation thereof and use thereof ASAHI GLASS COMPANY, LIMITED (JP) 2001-11-06 US disclosed
EP-1022300-A1 CATALYST FOR RING-OPENING POLYMERIZATION OF ALKYLENE OXIDE, METHOD FOR PREPARATION THEREOF AND USE THEREOF ASAHI GLASS COMPANY LTD. (JP) 2000-07-26 EP disclosed
US-5750640-A FUEL ADDITIVES SHELL OIL COMPANY (US) 1998-05-12 US disclosed
US-5546108-A Ink-jet type recorder having an ink carrier and letting ink by combined heat and eletrostatic force MINOLTA CAMERA KABUSHIKI KAISHA (JP) 1996-08-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170319720-A1 METHOD FOR PREPARING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AND METHOD FOR PURIFYING ORGANIC FLUORIDE-ALIPHATIC COMPOUND AFF1, OSBP, GBA1 MAPK1 1267/4885ALDH1A1 532/4885
US-20020131932-A1 Radiopharmaceuticals for diagnosing alzheimer's disease CCR1, CCR3, CCR2 MAPK1 2953/4885ALDH1A1 852/4885
US-20230219956-A1 QUINAZOLINE COMPOUND AND PHARMACEUTICAL APPLICATION THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, ABCG2, NQO2 MAPK1 4096/4885ALDH1A1 2410/4885
US-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 MAPK1 1347/4885ALDH1A1 3519/4885
US-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) SERPINA2, SERPINB1, SERPINE1 MAPK1 1773/4885ALDH1A1 542/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.