SCHEMBL450992

SCHEMBL450992

O=[N+]([O-])c1[c]nccn1

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
SCHEMBL2890918 0.65 MEN1 (0.35)
SCHEMBL4925010 0.64 KMT2A (0.38)
SCHEMBL3722614 0.64 KDM4E (0.41)
SCHEMBL9653160 0.64
SCHEMBL2042861 0.64
SCHEMBL4779502 0.62
SCHEMBL126630 0.62
Hydrazine SCHEMBL28990399 0.60 KDM4E (0.39)
Hydrazine SCHEMBL30355075 0.60 KDM4E (0.39)
SCHEMBL2042412 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2375898-B1 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-09-16 EP claimed
EP-0199096-B1 NITRO SUBSTITUTED HETEROARYL COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1989-12-20 EP claimed
EP-0199096-A1 Nitro substituted heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them MERCK & CO. INC. (US) 1986-10-29 EP claimed
US-4619927-A Novel nitropyrazinyl- and nitropyridinyl- substituted piperazin-3-one and hexahydro-1H-1,4-diazepin-5-one compounds useful as adjuncts to radiation therapy MERCK & CO., INC. (US) 1986-10-28 US claimed
US-9955689-B2 Method for promoting plant growth SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-05-01 US disclosed
US-9894901-B2 Method for promoting plant growth SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-20 US disclosed
US-9872493-B2 Method for promoting plant growth SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-23 US disclosed
EP-2997824-A1 NOVEL HERBICIDES Syngenta Participations AG. (CH) 2016-03-23 EP disclosed
US-20150305332-A1 METHOD FOR PROMOTING PLANT GROWTH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-29 US disclosed
US-20150289512-A1 METHOD FOR PROMOTING PLANT GROWTH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed
US-20150289506-A1 METHOD FOR PROMOTING PLANT GROWTH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed
US-20150282482-A1 METHOD FOR PROMOTING PLANT GROWTH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-08 US disclosed
EP-1243579-B1 PROCESS FOR THE PRODUCTION OF PYRIDINE DERIVATIVES SANKIO CHEMICAL CO LTD (JP) 2005-01-26 EP disclosed
US-6509469-B1 Reacting 1,2,4-triazine compound with vinyl carboxylate SANKIO CHEMICAL CO., LTD. (JP) 2003-01-21 US disclosed
EP-1243579-A1 PROCESS FOR THE PRODUCTION OF PYRIDINE DERIVATIVES Sankio Chemical Co., Ltd. (JP) 2002-09-25 EP disclosed
EP-0199096-B1 NITRO SUBSTITUTED HETEROARYL COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1989-12-20 EP disclosed
EP-0199096-A1 Nitro substituted heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them MERCK & CO. INC. (US) 1986-10-29 EP disclosed
US-4619927-A Novel nitropyrazinyl- and nitropyridinyl- substituted piperazin-3-one and hexahydro-1H-1,4-diazepin-5-one compounds useful as adjuncts to radiation therapy MERCK & CO., INC. (US) 1986-10-28 US disclosed
US-4619927-A Novel nitropyrazinyl- and nitropyridinyl- substituted piperazin-3-one and hexahydro-1H-1,4-diazepin-5-one compounds useful as adjuncts to radiation therapy MERCK & CO., INC. (US) 1986-10-28 US disclosed
US-4619927-A Novel nitropyrazinyl- and nitropyridinyl- substituted piperazin-3-one and hexahydro-1H-1,4-diazepin-5-one compounds useful as adjuncts to radiation therapy MERCK & CO., INC. (US) 1986-10-28 US disclosed