SCHEMBL2096958

SCHEMBL2096958

O=[N+]([O-])CCS

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
SCHEMBL7539406 0.80
SCHEMBL66347 0.76
SCHEMBL28430032 0.76 ALDH1A1 (0.56)
SCHEMBL9350197 0.72
SCHEMBL719096 0.69 ALDH1A1 (0.67)
SCHEMBL1011508 0.69
SCHEMBL10592150 0.69 ALDH1A1 (0.45)
SCHEMBL7400621 0.67
SCHEMBL16341166 0.67 ALDH1A1 (0.72)
SCHEMBL1311257 0.67 ALDH1A1 (0.72)

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
US-5384396-A Process for the deoxygenation of nucleosides THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1995-01-24 US claimed
WO-1992015598-A1 PROCESS FOR THE DEOXYGENATION OF NUCLEOSIDES UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1992-09-17 WO claimed
US-4252917-A ADDING A MERCAPTAN TO THE DOUBLE BONDS OF A BLOCK OR GRAFT COPOLYMER; WATER SWELLING; SEALANTS DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 1981-02-24 US claimed
US-4044020-A Process for preparing biotin SYNTEX (U.S.A.) INC. (US) 1977-08-23 US claimed
US-3966825-A Process for preparing β-nitroethanethiol SYNTEX (U.S.A.) INC. (US) 1976-06-29 US claimed
EP-4665401-A1 DRUG AND TREATMENT METHOD RadioVaxx GmbH (DE) 2025-12-24 EP disclosed
WO-2024170652-A1 DRUG AND TREATMENT METHOD RADIOVAXX GMBH (DE) 2024-08-22 WO disclosed
CN-104276987-B A kind of preparation method of mercaptan compound 黄河三角洲京博化工研究院有限公司 2016-08-17 CN disclosed
US-8664333-B2 Acetoacetic ester group-containing polyvinyl alcohol-based resin, resin composition, and uses thereof THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2014-03-04 US disclosed
US-8163832-B2 Aqueous emulsion and uses thereof THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2012-04-24 US disclosed
EP-1930352-B1 ACETOACETIC-ESTER-GROUP CONTAINING POLYVINYL ALCOHOL RESIN, RESIN COMPOSITION AND USE THEREOF NIPPON SYNTHETIC CHEM IND (JP) 2010-02-10 EP disclosed
US-20100029846-A1 Aqueous Emulsion and Uses Thereof THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2010-02-04 US disclosed
US-4223038-A THIENAMYCINS BEECHAM GROUP LIMITED (GB) 1980-09-16 US disclosed
EP-0002564-A1 Derivatives of 7-oxo-1-azabicyclo(3.2.0)-hept-2-ene-2-carboxylic acid, their preparation, pharmaceutical compositions containing them and intermediates BEECHAM GROUP PLC (GB) 1979-06-27 EP disclosed
US-4087438-A Thieno[3,4-d]furoxan and process for its preparation SYNTEX (U.S.A.) INC. (US) 1978-05-02 US disclosed
US-4044020-A Process for preparing biotin SYNTEX (U.S.A.) INC. (US) 1977-08-23 US disclosed
US-4044020-A Process for preparing biotin SYNTEX (U.S.A.) INC. (US) 1977-08-23 US disclosed
US-3966825-A Process for preparing β-nitroethanethiol SYNTEX (U.S.A.) INC. (US) 1976-06-29 US disclosed
US-3966825-A Process for preparing β-nitroethanethiol SYNTEX (U.S.A.) INC. (US) 1976-06-29 US disclosed
US-3966825-A Process for preparing β-nitroethanethiol SYNTEX (U.S.A.) INC. (US) 1976-06-29 US disclosed