SCHEMBL5259363

SCHEMBL5259363

O=S(=O)(Cl)n1ccnn1

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
SCHEMBL4947198 0.80
SCHEMBL9543479 0.75
SCHEMBL121557 0.75
Hydrochloric Acid SCHEMBL27680361 0.73
SCHEMBL4442023 0.70 HTT (0.44)
SCHEMBL7687590 0.66
SCHEMBL6820313 0.66 CYP2C19 (0.42)
SCHEMBL27999482 0.66 FOLH1 (0.35)
SCHEMBL4976458 0.65
SCHEMBL23808321 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1047862-A The preparation method of N-(3-(((aryl) amino) alkylsulfonyl)-1H-1,2,4-triazole-5-yl) amine DOWELANCO (US) 1990-12-19 CN claimed
WO-2020063756-A1 TRIAZOLE COMPOUND AND USE THEREOF IN AGRICULTURE Dongguan HEC Pesticides R&D Co., Ltd. (CN) 2020-04-02 WO disclosed
EP-3606910-A1 TRIAZOLE COMPOUND AND USE THEREOF IN AGRICULTURE Dongguan Hec Pesticides R&D Co., Ltd. (CN) 2020-02-12 EP disclosed
CN-105669576-B A kind of Fungicidal compounds, microbicide compositions and preparation and its application 浙江博仕达作物科技有限公司 2018-12-04 CN disclosed
WO-2018184579-A1 TRIAZOLE COMPOUND AND USE THEREOF IN AGRICULTURE DONGGUAN HEC TECH R&D CO., LTD. (CN) 2018-10-11 WO disclosed
CN-105669576-A Germicidal compound, germicide composition and preparation and application of germicide composition and preparation 华中师范大学 2016-06-15 CN disclosed
CN-104411311-A Substituted benzamides and their use UNIV LELAND STANFORD JUNIOR 2015-03-11 CN disclosed
CN-103327972-A Substituted benzamides and their uses UNIV LELAND STANFORD JUNIOR 2013-09-25 CN disclosed
CN-101918406-B Compounds for the treatment of hepatitis c BRISTOL MYERS SQUIBB CO 2013-04-17 CN disclosed
CN-102471327-A Inhibitors of flaviviridae viruses GILEAD SCIENCES INC 2012-05-23 CN disclosed
US-6680388-B2 HEATING 2,6-DICHLORO-3-METHYLANILINE WITH 5-AMINO-3-CHLORO-SULFONYL-1,2,4-TRIAZOLE, TO FORM CHEMICAL INTERMEDIATES FOR TRIAZOLO(1,5-A)PYRIMIDINE HERBICIDES BAYER CROPSCIENCE AG (DE) 2004-01-20 US disclosed
US-20030162975-A1 Method for preparing substituted 5-amino-n-phenyl-1,2,4-triazole-3-sulfonamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-08-28 US disclosed
EP-1296962-A1 METHOD FOR PREPARING SUBSTITUTED 5-AMINO-N-PHENYL-1,2,4-TRIAZOLE-3-SULFONAMIDES Bayer Aktiengesellschaft (DE) 2003-04-02 EP disclosed
WO-2001096316-A1 METHOD FOR PREPARING SUBSTITUTED 5-AMINO-N-PHENYL-1,2,4-TRIAZOLE-3-SULFONAMIDES BAYER CROPSCIENCE AG (DE) 2001-12-20 WO disclosed
CN-1037568-C Phosphosulfonate herbicides ROHM & HAAS (US) 1998-03-04 CN disclosed
CN-1165143-A Phosphosulfonate herbicides ROHM & HAAS (US) 1997-11-19 CN disclosed
CN-1165144-A Phosphosulfonate herbicides ROHM & HAAS (US) 1997-11-19 CN disclosed
EP-0427336-B1 Process for the preparation of 5-amino-3-chlorosulfonyl-1,2,4-triazole DOWELANCO (US) 1995-02-01 EP disclosed
EP-0427336-A1 Process for the preparation of 5-amino-3-chlorosulfonyl-1,2,4-triazole DOWELANCO (US) 1991-05-15 EP disclosed
US-5008396-A Process for the preparation of 5-amino-3-chlorosulfonyl-1,2,4-triazole DOWELANCO (US) 1991-04-16 US disclosed