SCHEMBL456770

SCHEMBL456770

O=C(O)CO[N+](=O)[O-]

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
SCHEMBL28185249 0.97
Phosphoric Acid SCHEMBL305359 0.91 ALDH1A1 (0.36)
Ether SCHEMBL5066675 0.87 ALDH1A1 (0.33)
SCHEMBL20377293 0.82 TSHR (0.33)
Citric Acid SCHEMBL3862968 0.82 ALDH1A1 (0.56)
SCHEMBL11671911 0.80 ALDH1A1 (0.36)
SCHEMBL8939307 0.79 THRB (0.34)
SCHEMBL2230834 0.79 ALDH1A1 (0.34)
SCHEMBL28104919 0.78
SCHEMBL4735665 0.77 BLM (0.33)

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
CN-109845747-A A kind of antiseptic paint agent and its preparation and application preventing and treating hickory nut dry rot 杭州市临安区林业局 2019-06-07 CN claimed
US-6682616-B1 THERMALLY STABLE; GENERATING LESS CARBON MONOXIDE AND CHLORINE CONTAINING GASES DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-01-27 US claimed
EP-1205459-A1 GAS-GENERATING AGENT COMPOSITION FOR PRETENTIONER Daicel Chemical Industries, Ltd. (JP) 2002-05-15 EP claimed
JP-11171680-A None JP disclosed
JP-8207428-A None JP disclosed
CN-119055583-A Multifunctional injectable hydrogel for treating ischemic cerebral apoplexy and preparation method and application thereof 四川大学 2024-12-03 CN disclosed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
EP-3094333-B1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2020-10-14 EP disclosed
CN-109845747-A A kind of antiseptic paint agent and its preparation and application preventing and treating hickory nut dry rot 杭州市临安区林业局 2019-06-07 CN disclosed
US-10266511-B2 No-releasing nitrooxy-chromene conjugates Euclises Pharmaceuticals, Inc. (US) 2019-04-23 US disclosed
US-20160340330-A1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES Euclises Pharmaceuticals, Inc. 2016-11-24 US disclosed
US-6682616-B1 THERMALLY STABLE; GENERATING LESS CARBON MONOXIDE AND CHLORINE CONTAINING GASES DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-01-27 US disclosed
US-20030097953-A1 Gas generating composition and gas generator NOF CORPORATION (JP) 2003-05-29 US disclosed
US-20020121321-A1 Gas-generating compositions NOF CORPORATION (JP) 2002-09-05 US disclosed
EP-1205459-A1 GAS-GENERATING AGENT COMPOSITION FOR PRETENTIONER Daicel Chemical Industries, Ltd. (JP) 2002-05-15 EP disclosed
JP-2000119088-A GAS GENERATION AGENT COMPOSITION FOR PRETENSIONER DAICEL CHEM IND LTD 2000-04-25 JP disclosed
JP-H11171680-A HIGH-PERFORMANCE GUNPOWDER COMPOSITION ASAHI CHEM IND CO LTD 1999-06-29 JP disclosed
JP-H08207428-A ACCEPTING BODY FOR OVERHEAD PROJECTOR ASIA GENSHI KK 1996-08-13 JP disclosed
US-5489705-A REACTING GLYOXYLIC ACID WITH MENTHOL FOLLOWED BY SODIUM METABISULFITE SOCIETE FRANCAISE HOECHST (FR) 1996-02-06 US disclosed
US-5442094-A Prepared by reacting aqueous solution of glyoxylic acid with menthol under acidic conditions, eliminating water by azeotropic distillation with hydrocarbon, treating with sulfurous acid derivative SOCIETE FRANCAISE HOECHST (FR) 1995-08-15 US disclosed