SCHEMBL3632057

SCHEMBL3632057

CC(=O)C(C)(C)C(=O)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
Isopropyl Alcohol SCHEMBL11075054 0.86 ALDH1A1 (0.36)
SCHEMBL52160 0.81
SCHEMBL93224 0.81
SCHEMBL11572530 0.79 TSHR (0.47)
SCHEMBL9716539 0.77 LMNA (0.39)
SCHEMBL107651 0.77 TSHR (0.53)
SCHEMBL106724 0.77 TSHR (0.53)
Hydrochloric Acid SCHEMBL808934 0.77 TSHR (0.53)
Hydrochloric Acid SCHEMBL4682921 0.77 TSHR (0.53)
SCHEMBL11587164 0.77 TSHR (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115212277-B Preparation method of ginseng and antler sanitary pills 江西大自然制药有限公司 2023-11-10 CN claimed
EP-0912467-B1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE SA (FR) 2002-04-24 EP claimed
JP-11069977-A None JP disclosed
US-12552959-B2 Aqueous coating composition for corrosion protection ALLNEX AUSTRIA GMBH (AT) 2026-02-17 US disclosed
US-20240245691-A1 2-METHYLENE-4-OXO-BUTANOIC ACID DERIVATIVES FOR THE TREATMENT OF INFLAMMATION SITRYX THERAPEUTICS LIMITED (GB) 2024-07-25 US disclosed
US-20240084167-A1 AQUEOUS COATING COMPOSITION FOR CORROSION PROTECTION ALLNEX AUSTRIA GMBH (AT) 2024-03-14 US disclosed
EP-4330335-A1 AQUEOUS COATING COMPOSITION FOR CORROSION PROTECTION Allnex Austria GmbH (AT) 2024-03-06 EP disclosed
EP-4330231-A1 2-METHYLENE-4-OXO-BUTANOIC ACID DRIVATIVES FOR THE TREATMENT OF INFLAMMATION Sitryx Therapeutics Limited (GB) 2024-03-06 EP disclosed
US-20230400766-A1 ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-14 US disclosed
US-20230399287-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-12-14 US disclosed
US-20230399287-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-12-14 US disclosed
EP-0558603-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1993-09-08 EP disclosed
WO-1992008688-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 WO disclosed
WO-1992008699-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 WO disclosed
EP-0369288-A1 Pyranyl ethyl naphthalene derivatives, their preparation and use as medicines F. HOFFMANN-LA ROCHE AG (CH) 1990-05-23 EP disclosed
US-4514361-A 2,4-DIHYDROXYBENZOIC ACID, PHENYLPROPIOLIC ACID OR SALTS; BROMCRESOL PURPLE ARVEY CORPORATION (US) 1985-04-30 US disclosed
EP-0105420-A1 Steam sterilization indicator ARVEY CORPORATION (US) 1984-04-18 EP disclosed
US-4056537-A CYCLIZATION, ACID CATALYST AYERST MCKENNA AND HARRISON LTD. (CA) 1977-11-01 US disclosed
US-3974179-A ANTIINFLAMMATORY, ANALGESICS, BACTERICIDES, FUNGICIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1976-08-10 US disclosed
US-3939178-A ANTIINFLAMMATORY, ANALGESIC, BACTERICIDE, FUNGICIDE AMERICAN HOME PRODUCTS CORPORATION (US) 1976-02-17 US disclosed