SCHEMBL577440

SCHEMBL577440

CCc1c[nH]nn1

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
Hydrochloric Acid SCHEMBL12821847 0.95
SCHEMBL4864404 0.75
SCHEMBL28201637 0.75
SCHEMBL2657374 0.75
SCHEMBL12854037 0.75
SCHEMBL1680480 0.74
SCHEMBL461534 0.74
SCHEMBL6483604 0.74
SCHEMBL29857 0.74
SCHEMBL1680479 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 493 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271956-A1 AMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2023-08-31 US claimed
EP-4121429-A1 CONDENSED PYRIDINE DERIVASTIVES SUBSTITUED BY AMIDE FUNCTIONS AS ACSS2 INHIBITORS Merck Patent GmbH (DE) 2023-01-25 EP claimed
WO-2021185789-A1 CONDENSED PYRIDINE DERIVASTIVES SUBSTITUED BY AMIDE FUNCTIONS AS ACSS2 INHIBITORS MERCK PATENT GMBH (DE) 2021-09-23 WO claimed
EP-2461811-B1 MACROCYCLIC SERINE PROTEASE INHIBITORS USEFUL AGAINST VIRAL INFECTIONS, PARTICULARLY HCV IDENIX PHARMACEUTICALS LLC (US) 2016-04-20 EP claimed
CN-105399759-A Zinc complex containing bi(triazol) ethane and pyrazine diacid and preparation method of zinc complex UNIV TIANJIN POLYTECHNIC 2016-03-16 CN claimed
US-8993595-B2 Macrocyclic serine protease inhibitors IDENIX PHARMACEUTICALS, INC. (US) 2015-03-31 US claimed
US-8852320-B2 Preparation of metal-triazolate frameworks THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-10-07 US claimed
CN-103833652-A Triazole ionic liquid, and preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2014-06-04 CN claimed
CN-103429597-A Preparation of metal-triazolate frameworks UNIV CALIFORNIA 2013-12-04 CN claimed
US-20130224147-A1 MACROCYCLIC SERINE PROTEASE INHIBITORS IDENIX PHARMACEUTICALS, INC. (US) 2013-08-29 US claimed
US-5747439-A Aqueous sodium salt metal cleaner CHURCH & DWIGHT CO, INC. (US) 1998-05-05 US claimed
US-5736495-A AQUEOUS SOLUTION OF ALKALINE METAL SALT, SURFACTANT, ANTICORROSION AGENT COMPRISING TRIAZOLE COMPOUND AND ALKALI METAL BORATE CHURCH & DWIGHT CO., INC. (US) 1998-04-07 US claimed
EP-0599485-B1 Method of inhibiting corrosion in aqueous systems BETZ EUROP INC (US) 1996-06-26 EP claimed
US-5389663-A Fungicides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US claimed
EP-0599485-A1 Method of inhibiting corrosion in aqueous systems BETZ EUROPE, INC. (US) 1994-06-01 EP claimed
US-5304568-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1994-04-19 US claimed
US-5266584-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1993-11-30 US claimed
US-5256332-A Using mixture of an orthophosphate, 1,2,3-triazole compound, polyepoxysuccinic acid and copolymer of acrylic acid and allyl hydroxypropyl sulfonate ether BETZ LABORATORIES, INC. (US) 1993-10-26 US claimed
US-4696922-A NEMATOSIDES CIBA-GEIGY CORPORATION (US) 1987-09-29 US claimed
EP-0184989-A1 5-Azolylacetoxy-milbemycin as an ecto-and endoparasitic agent CIBA-GEIGY AG (CH) 1986-06-18 EP claimed