SCHEMBL3237221

SCHEMBL3237221

N#CC(=O)c1cccs1

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
SCHEMBL9547941 0.82 CES2 (0.62)
SCHEMBL143645 0.80
SCHEMBL9432069 0.80
SCHEMBL11198155 0.77 CES2 (0.50)
SCHEMBL11198165 0.77 CES2 (0.50)
SCHEMBL11345781 0.76 CES2 (0.55)
SCHEMBL11345762 0.76 CES2 (0.55)
SCHEMBL17303312 0.75 CES2 (0.54)
Thiophene Carboxylic Acid SCHEMBL2355560 0.75 DAO (0.76)
Thiophene Carboxylic Acid SCHEMBL30775706 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4453969-A Thienylglyoxylonitrile oximino phenylcarbamates for the protection of crops against injury by herbicides CIBA-GEIGY CORPORATION (US) 1984-06-12 US claimed
US-4234737-A Process for preparing thienylglyoxylic acids and amides STAUFFER CHEMICAL COMPANY (US) 1980-11-18 US claimed
EP-3888691-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS Hangzhou Dac Biotech Co., Ltd. (CN) 2021-10-06 EP disclosed
EP-1167366-B1 AMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2010-05-05 EP disclosed
US-6562849-B1 Amine compound or pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc. SANKYO COMPANY, LIMITED (JP) 2003-05-13 US disclosed
US-20030078426-A1 Amine derivative compounds SANKYO COMPANY, LIMITED (JP) 2003-04-24 US disclosed
EP-1167366-A1 AMINE DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP disclosed
EP-0707578-A1 2-OXIMINO-2-THIENYL-ACETIC ACID DERIVATIVES BAYER AG (DE) 1996-04-24 EP disclosed
WO-1995001973-A1 2-OXIMINO-2-THIENYL-ACETIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1995-01-19 WO disclosed
US-4453969-A Thienylglyoxylonitrile oximino phenylcarbamates for the protection of crops against injury by herbicides CIBA-GEIGY CORPORATION (US) 1984-06-12 US disclosed
US-4234737-A Process for preparing thienylglyoxylic acids and amides STAUFFER CHEMICAL COMPANY (US) 1980-11-18 US disclosed