SCHEMBL537705

SCHEMBL537705

CC(C)CC(C)I

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
SCHEMBL14987875 1.00
SCHEMBL7030592 0.82
SCHEMBL15977039 0.82 ALDH1A1 (0.35)
SCHEMBL24305937 0.77 TSHR (0.32)
SCHEMBL13743850 0.75
SCHEMBL22789504 0.73
SCHEMBL38322 0.71
SCHEMBL16468814 0.71
SCHEMBL22887521 0.69
SCHEMBL8621790 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115735262-A Robust ashable hard mask 朗姆研究公司 2023-03-03 CN disclosed
CN-105377812-B The preparation method of 2- amino -2- oximido-N- alkoxy acetimidoyl cyanides and its prepare intermediate 组合化学工业株式会社 2018-09-18 CN disclosed
EP-3012247-B1 MANUFACTURING METHOD FOR 2-AMINO-2-HYDROXYIMINO-N-ALKOXY ACETOIMIDOYL CYANIDE, AND MANUFACTURING INTERMEDIATE THEREOF KUMIAI CHEMICAL INDUSTRY CO (JP) 2018-01-10 EP disclosed
WO-2016182968-A1 NOVEL SYRINGOLIN ANALOGUES AND METHODS OF MAKING AND USING SAME BROWN UNIVERSITY (US) 2016-11-17 WO disclosed
EP-3012247-A2 MANUFACTURING METHOD FOR 2-AMINO-2-HYDROXYIMINO-N-ALKOXY ACETOIMIDOYL CYANIDE, AND MANUFACTURING INTERMEDIATE THEREOF Ihara Chemical Industry Co., Ltd. (JP) 2016-04-27 EP disclosed
CN-105377812-A Manufacturing method for 2-amino-2-hydroxyimino-n-alkoxy acetoimidoyl cyanide, and manufacturing intermediate thereof IHARA CHEMICAL IND CO 2016-03-02 CN disclosed
EP-1990336-B1 PROCESS FOR PRODUCTION OF 5-ALKOXY-4-HYDROXYMETHYLPYRAZOLE COMPOUND IHARA CHEMICAL IND CO (JP) 2012-02-08 EP disclosed
US-20110274925-A1 POLY (N - ALKYLCARBAZOLE) COLUMNAR STRUCTURE AND METHOD FOR PRODUCING THE SAME NATIONAL UNIVERSITY CORPORATION CHIBA UNIVERSITY (JP) 2011-11-10 US disclosed
EP-1813594-B1 POLYMERIZABLE COMPOUND AND COMPOSITION CONTAINING THE POLYMERIZABLE COMPOUND ADEKA CORP (JP) 2011-05-11 EP disclosed
US-20110017958-A1 ORGANIC TRANSPARENT ELECTROCONDUCTIVE MATERIAL, INK FOR FORMING ORGANIC TRANSPARENT ELECTROCONDUCTIVE MATERIAL, AND METHODS FOR PRODUCING THEM NATIONAL UNIVERSITY CORPORATION CHIBA UNIVERSITY (JP) 2011-01-27 US disclosed
US-20070270521-A1 Transition metal compound, polymerization-initiator system comprising the same, and process for producing polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2007-11-22 US disclosed
EP-0719839-B1 Phthalocyanine compounds and optical recording media comprising them MITSUI CHEMICALS INC (JP) 2001-07-25 EP disclosed
US-5922239-A AN INEXPENSIVE BASE OIL USE AS A WORKING FLUID COMPOSITION FOR A REFRIGERATING MACHINE, HAVING EXCELLENT COMPATIBILITY WITH HYDROFLUOROCARBONS, HYDROLYSIS RESISTANCE, ADEQUATE KINEMATIC VISCOSITY, GOOD FLUIDITY AT LOW TEMPERATURES KAO CORPORATION (JP) 1999-07-13 US disclosed
US-5869702-A SPECIALTY OILS FOR REFRIGERATORS KAO CORPORATION (JP) 1999-02-09 US disclosed
US-5720895-A CONSISTS OF HYDROFLUOROCARBONS, A REFRIGERATION OIL CONTAINING POLYOL ETHER DERIVATIVES AS A BASE OIL KAO CORPORATION (JP) 1998-02-24 US disclosed
US-5693396-A NEAR INFRARED LIGHT ABSORBERS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-12-02 US disclosed
EP-0719839-A2 Phthalocyanine compounds and optical recording media comprising them MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-07-03 EP disclosed
EP-0696564-A1 Polyol ether derivatives and production methods therefor KAO CORPORATION (JP) 1996-02-14 EP disclosed
US-5328635-A Compounds for corrosion resistance, antifoam agents or moisture scavengers ANGUS CHEMICAL COMPANY (US) 1994-07-12 US disclosed
US-5223174-A MOISTURE-SCAVENGING IMINOALCOHOL-OXAZOLIDINE MIXTURES ANGUS CHEMICAL COMPANY (US) 1993-06-29 US disclosed