SCHEMBL6863642

SCHEMBL6863642

NC1C=CC=CC1(F)[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
SCHEMBL1692524 0.78
SCHEMBL28444613 0.77
SCHEMBL6410731 0.76
SCHEMBL9698656 0.76
SCHEMBL1592496 0.76
SCHEMBL4694810 0.74
SCHEMBL630894 0.73
SCHEMBL2011845 0.73
SCHEMBL311015 0.72
SCHEMBL856758 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110452152-A 1,3- dioxoisoindolin benzamide compound and application thereof INST MATERIA MEDICA CAMS 2019-11-15 CN claimed
CN-109071782-A Use of donor-acceptor polymers based on fluorobenzooxadiazoles in electronics and photonics 香港科技大学 2018-12-21 CN claimed
CN-108948011-A A kind of preparation method of the sandy star in pula 华南农业大学 2018-12-07 CN claimed
CN-105669520-A Tryptophan basic skeleton-containing o-phenylenediamine selective histone deacetylase inhibitor and its preparation method and use 山东大学 2016-06-15 CN claimed
CN-104407066-A Analysis method of retigabine related substances ANHUI WANBANG MEDICAL TECHNOLOGY CO LTD 2015-03-11 CN claimed
CN-116348114-A Thiobenzimidazole derivatives or pharmaceutically acceptable salts thereof and use thereof 高丽大学校产学协力团 2023-06-27 CN disclosed
CN-114787136-A Substituted benzimidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN disclosed
US-11078189-B2 Pharmaceutical compounds ReViral Limited (GB) 2021-08-03 US disclosed
CN-107935858-B Preparation method of 5-fluoro-2-nitrophenol 利尔化学股份有限公司 2020-09-08 CN disclosed
US-20200172515-A1 PHARMACEUTICAL COMPOUNDS SILICON VALLEY BANK 2020-06-04 US disclosed
CN-110452152-A 1,3- dioxoisoindolin benzamide compound and application thereof INST MATERIA MEDICA CAMS 2019-11-15 CN disclosed
CN-110446699-A 2(1H) -quinolinone derivatives TAISHO PHARMACEUTICAL CO LTD 2019-11-12 CN disclosed
CN-105307657-A Heteroaryl compounds and uses thereof CELGENE AVILOMICS RES INC 2016-02-03 CN disclosed
CN-105163738-A MK2 inhibitors and uses thereof CELGENE AVILOMICS RES INC 2015-12-16 CN disclosed
CN-104407066-A Analysis method of retigabine related substances ANHUI WANBANG MEDICAL TECHNOLOGY CO LTD 2015-03-11 CN disclosed
CN-103004799-B Application of benzofuroxan derivative to resisting plant pathogenic fungi UNIV SOOCHOW 2014-12-31 CN disclosed
CN-104024248-A SERINE/THREONINE PAK1 INHIBITORS HOFFMANN LA ROCHE 2014-09-03 CN disclosed
CN-103492028-A Novel sulfonaminoquinoline hepcidin antagonists VIFOR INT AG 2014-01-01 CN disclosed
EP-1379522-A1 DIHYDRO-BENZO(b)(1,4)DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I F. HOFFMANN-LA ROCHE AG (CH) 2004-01-14 EP disclosed
WO-2002083665-A1 DIHYDRO-BENZO[b][1,4]DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I F. HOFFMANN-LA ROCHE AG (CH) 2002-10-24 WO disclosed