SCHEMBL3044129

SCHEMBL3044129

S=C=NCCCCl

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
SCHEMBL1024885 0.81
SCHEMBL1854857 0.81
SCHEMBL484045 0.81 MIF (0.68)
SCHEMBL7133119 0.78 NAAA (0.74)
SCHEMBL1999782 0.78 NAAA (0.74)
SCHEMBL1233523 0.78 NAAA (0.74)
SCHEMBL6697263 0.78 NAAA (0.74)
SCHEMBL2149597 0.78 NAAA (0.74)
SCHEMBL330913 0.78 NAAA (0.74)
SCHEMBL27170957 0.78 NAAA (0.74)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110143901-A A kind of Synthesis method of sulforaphane 哈尔滨辉禾眼科医疗科技发展有限公司 2019-08-20 CN claimed
US-20250282796-A1 PENEM ANTIBACTERIALS AGAINST MYCOBACTERIAL PATHOGENS AND D,D- AND L,D TRANSPEPTIDASES THE JOHNS HOPKINS UNIVERSITY 2025-09-11 US disclosed
WO-2023235456-A1 PENEM ANTIBACTERIALS AGAINST MYCOBACTERIAL PATHOGENS AND D,D- AND L,D TRANSPEPTIDASES THE JOHNS HOPKINS UNIVERSITY (US) 2023-12-07 WO disclosed
WO-2023235456-A1 PENEM ANTIBACTERIALS AGAINST MYCOBACTERIAL PATHOGENS AND D,D- AND L,D TRANSPEPTIDASES THE JOHNS HOPKINS UNIVERSITY (US) 2023-12-07 WO disclosed
CN-110143901-A A kind of Synthesis method of sulforaphane 哈尔滨辉禾眼科医疗科技发展有限公司 2019-08-20 CN disclosed
CN-110143901-A A kind of Synthesis method of sulforaphane 哈尔滨辉禾眼科医疗科技发展有限公司 2019-08-20 CN disclosed
US-9642363-B2 N-arylamidine-substituted trifluoroethyl sulfide derivatives as acaricides and insecticides BAYER CROPSCIENCE AG (DE) 2017-05-09 US disclosed
US-9642363-B2 N-arylamidine-substituted trifluoroethyl sulfide derivatives as acaricides and insecticides BAYER CROPSCIENCE AG (DE) 2017-05-09 US disclosed
US-20170057914-A1 N-ARYLAMIDINE-SUBSTITUTED TRIFLUOROETHYL SULFIDE DERIVATIVES AS ACARICIDES AND INSECTICIDES BAYER CROPSCIENCE AG 2017-03-02 US disclosed
EP-2086963-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-09-16 EP disclosed
WO-2008060927-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-22 WO disclosed
WO-2008060927-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-22 WO disclosed
US-20080119461-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2008-05-22 US disclosed
EP-0017153-B1 NOVEL PYRAZINECARBOXAMIDES, PROCESSES FOR PREPARING AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME MERCK & CO. INC. (US) 1983-01-26 EP disclosed
EP-0020304-A1 Guanidines, process for their preparation, pharmaceutical preparations containing such compounds and their application CIBA-GEIGY AG (CH) 1980-12-10 EP disclosed
EP-0017153-A1 Novel pyrazinecarboxamides, processes for preparing and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1980-10-15 EP disclosed
US-4224447-A DIURETICS MERCK & CO., INC. (US) 1980-09-23 US disclosed
US-4221798-A Hypotensive 2-heterocycloamino-imidazolines BEIERSDORF AKTIENGESELLSCHAFT (DE) 1980-09-09 US disclosed
US-4208327-A CENTRAL NERVOUS SYSTEM ACTIVITY G. D. SEARLE & CO. (US) 1980-06-17 US disclosed
US-4008243-A Antiviral thiazolinyl or thiazinyl benzimidazole esters ELI LILLY AND COMPANY (US) 1977-02-15 US disclosed