SCHEMBL294134

SCHEMBL294134

CC(C)COCC[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
SCHEMBL10530513 0.95 ALDH1A1 (0.35)
SCHEMBL713562 0.83
SCHEMBL710231 0.81 SPHK1 (0.37)
SCHEMBL723497 0.81 HSD17B10 (0.41)
SCHEMBL8810518 0.80 ALDH1A1 (0.36)
SCHEMBL2527671 0.79 SPHK1 (0.39)
SCHEMBL2525588 0.79 SPHK1 (0.39)
SCHEMBL8141757 0.78
SCHEMBL8304406 0.78 HSD17B10 (0.32)
SCHEMBL725089 0.78 HSD17B10 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107109201-A Polymer composition 雪佛龙美国公司 2017-08-29 CN claimed
US-8461135-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2013-06-11 US claimed
WO-2012176123-A1 3 - IMIDAZOLYL- INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2012-12-27 WO claimed
US-8039450-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2011-10-18 US claimed
WO-1997031534-A1 USE OF N-PHOSPHONOMETHYLGLYCINE ESTERS IN AQUEOUS SOLUTION AS HERBICIDES, AND NEW N-PHOSPHONOMETHYLGLYCINE ESTERS BAYER AKTIENGESELLSCHAFT (DE) 1997-09-04 WO claimed
CN-114423742-B Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-05-28 CN disclosed
EP-4143167-B1 PESTICIDAL COMPOUNDS BASF SE (DE) 2024-05-15 EP disclosed
CN-117777086-A Antistatic auxiliary agent 广荣化学株式会社 2024-03-29 CN disclosed
WO-2024061768-A1 AZOLE PESTICIDAL COMPOUNDS BASF SE (DE) 2024-03-28 WO disclosed
WO-2024028243-A1 PYRAZOLO PESTICIDAL COMPOUNDS BASF SE (DE) 2024-02-08 WO disclosed
CN-117466830-A Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-01-30 CN disclosed
WO-2024005030-A1 DIPHENYLETHENE-BASED COMPOUND, LIGHT ABSORBER, RESIN COMPOSITION, AND USE THEREOF 山本化成株式会社 2024-01-04 WO disclosed
EP-0218137-A2 Water soluble aminonaphthol disazo dyes, their preparation and their use CASSELLA Aktiengesellschaft (DE) 1987-04-15 EP disclosed
EP-0193887-A2 Substituted O-sulfonyl-glycosyl amides, method for their preparation and their use as mediacments BAYER AG (DE) 1986-09-10 EP disclosed
US-4574122-A ANTIBODIES, IMMUNOLOGY BAYER AKTIENGESELLSCHAFT (DE) 1986-03-04 US disclosed
EP-0149760-A2 Substituted O-acyl glycosylamides, methods for their preparation and their use BAYER AG (DE) 1985-07-31 EP disclosed
EP-0144894-A2 Therapeutic application of substituted O-acyl-glycosides BAYER AG (DE) 1985-06-19 EP disclosed
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 US disclosed
US-4451285-A Herbicidal 2-haloacetanilides MONSANTO COMPANY (US) 1984-05-29 US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 US disclosed