SCHEMBL454918

SCHEMBL454918

CC(=O)C[S+](C)[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
SCHEMBL13380708 0.78 ALDH1A1 (0.39)
SCHEMBL8153060 0.78 TDP1 (0.32)
SCHEMBL4442753 0.75
SCHEMBL9640216 0.75
SCHEMBL2177849 0.75
SCHEMBL9641013 0.75
SCHEMBL3328498 0.73
SCHEMBL686322 0.73
SCHEMBL2476307 0.73
Potassium Ion SCHEMBL11581788 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100999542-A Green synthesizing process of rape cin lactone and its analogue TAOPU AGRICULTURAL CHEMISTRY C (CN) 2007-07-18 CN claimed
EP-3045450-B1 INTERMEDIATE COMPOUNDS IN PROCESSES FOR PRODUCING PYRIDAZINONE COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2018-02-07 EP disclosed
US-20170298085-A1 CARBAMATE, ESTER, AND KETONE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-10-19 US disclosed
US-9732103-B2 Carbamate, ester, and ketone compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
EP-3045450-A1 INTERMEDIATE COMPOUNDS IN A PROCESS FOR PRODUCING PYRIDAZINONE COMPOUNDS SUMITOMO CHEMICAL CO., LTD. (JP) 2016-07-20 EP disclosed
EP-2614053-B1 METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATES THEREOF SUMITOMO CHEMICAL CO (JP) 2016-03-23 EP disclosed
US-9271499-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-01 US disclosed
US-9266830-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-02-23 US disclosed
US-20150239919-A1 Carbamate, Ester, and Ketone Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2015-08-27 US disclosed
US-9040709-B2 Method for producing pyridazinone compounds and intermediate thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-05-26 US disclosed
EP-2110416-A2 Dispersion of water-insoluble colorant, method of producing substance containing water-insoluble colorant, fine particles of water-insoluble colorant, dispersing agent for water-insoluble colorant, and recording liquid, ink set, printed article, method of forming image and image forming apparatus using the same Fujifilm Corporation (JP) 2009-10-21 EP disclosed
US-20090246481-A1 DISPERSION OF WATER-INSOLUBLE COLORANT, METHOD OF PRODUCING SUBSTANCE CONTAINING WATER-INSOLUBLE COLORANT, FINE PARTICLES OF WATER-INSOLUBLE COLORANT, DISPERSING AGENT FOR WATER-INSOLUBLE COLORANT, AND RECORDING LIQUID, INK SET, PRINTED ARTICLE, METHOD OF FORMING IMAGE AND IMAGE FORMING APPARATUS USING THE SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
US-20090183982-A1 Method for Manufacturing Triarylpyrazine Derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2009-07-23 US disclosed
US-20090042907-A1 Bicyclic aromatic sulfinyl derivatives CEPHALON, INC. (US) 2009-02-12 US disclosed
US-7423176-B2 Bicyclic aromatic sulfinyl derivatives CEPHALON, INC. (US) 2008-09-09 US disclosed
US-20070249862-A1 Process for the Production of Polyisocyanate/Polysilicic Acid Based Resins with Widely Variable Processability and Setting Periods CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2007-10-25 US disclosed
CN-100999542-A Green synthesizing process of rape cin lactone and its analogue TAOPU AGRICULTURAL CHEMISTRY C (CN) 2007-07-18 CN disclosed
EP-0068371-B1 PROCESS FOR PREPARING SULFIDES BASF Aktiengesellschaft (DE) 1984-03-21 EP disclosed
US-4438282-A REDUCTION OF SULFOXIDE WITH HYDRAZINE OR HYDROXYLAMINE OR DERIVATIVE BASF AKTIENGESELLSCHAFT (DE) 1984-03-20 US disclosed
EP-0068371-A1 Process for preparing sulfides BASF Aktiengesellschaft (DE) 1983-01-05 EP disclosed