SCHEMBL5223756

SCHEMBL5223756

C[CH]CCOC(C)(C)C

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
SCHEMBL28054359 0.81 ALDH1A1 (0.30)
SCHEMBL18248670 0.79
SCHEMBL4300325 0.74
SCHEMBL3161672 0.74
SCHEMBL2096128 0.74
SCHEMBL237181 0.73 MAPK1 (0.40)
SCHEMBL25194572 0.72 TSHR (0.35)
SCHEMBL11042232 0.72 TDP1 (0.33)
SCHEMBL11889400 0.70
SCHEMBL13534541 0.70

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019039839-A2 METHOD FOR EVALUATING INJECTION PHYSICAL PROPERTY OF PLASTIC RESIN, AND POLYETHYLENE RESIN SUITABLE FOR INJECTION MOLDING 주식회사 엘지화학 2019-02-28 WO disclosed
WO-2018117403-A1 HYBRID SUPPORTED METALLOCENE CATALYST, AND METHOD FOR PREPARING POLYOLEFIN BY USING SAME 주식회사 엘지화학 2018-06-28 WO disclosed
CN-106928404-A Monovinylarene-conjugated diene copolymer and preparation method and SB and tire 中国石油化工股份有限公司 2017-07-07 CN disclosed
US-20070287086-A1 Colored photosensitive resin composition, color filter, image sensor, and camera system SONY CORPORATION (JP) 2007-12-13 US disclosed
EP-1860502-A1 Colored photosensitive resin composition, color filter, image sensor, and camera system Sumitomo Chemical Company, Limited (JP) 2007-11-28 EP disclosed
CN-101078877-A Colored photosensitive resin composition, color filter, image sensor, and camera system SUMITOMO CHEMICAL CO (JP) 2007-11-28 CN disclosed
EP-0944623-B1 SUBSTITUTED PYRAZOLE-3-YL BENZAZOLES BASF AG (DE) 2004-09-01 EP disclosed
EP-0628026-B1 CYANO-OXIME ETHERS, PROCESS FOR PRODUCING THEM, AGENTS CONTAINING THEM AND THEIR USE BASF AG (DE) 1997-01-22 EP disclosed
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed
EP-0628026-A1 CYANO-OXIME ETHERS, PROCESS FOR PRODUCING THEM, AGENTS CONTAINING THEM AND THEIR USE. BASF AG (DE) 1994-12-14 EP disclosed
WO-1993016985-A1 CYANO-OXIME ETHERS, PROCESS FOR PRODUCING THEM, AGENTS CONTAINING THEM AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1993-09-02 WO disclosed