SCHEMBL449344

SCHEMBL449344

O=[N+]([O-])c1cc[c]cn1

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
SCHEMBL5610043 0.71 MAPT (0.42)
SCHEMBL5935155 0.70 RAB9A (0.46)
SCHEMBL29027932 0.67 MAPT (0.43)
SCHEMBL448240 0.67
Water SCHEMBL28219863 0.67 KDM4E (0.43)
Water SCHEMBL16702558 0.67 KDM4E (0.43)
SCHEMBL258797 0.65
SCHEMBL16031 0.64
SCHEMBL28139668 0.64 ALDH1A1 (0.55)
SCHEMBL170158 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111909082-B Pyridine hydrazone derivatives, and preparation method and application thereof 湖南大学 2022-09-13 CN claimed
CN-111909082-A Pyridine hydrazone derivatives, and preparation method and application thereof 湖南大学 2020-11-10 CN claimed
CN-104961785-B A kind of novel acyl lactone derivative and preparation method thereof 北京理工大学 2019-01-11 CN claimed
CN-104961785-A Novel acylide derivative and preparing method thereof BEIJING INST TECHNOLOGY 2015-10-07 CN claimed
EP-2375898-B1 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-09-16 EP claimed
CN-117751117-A SARM1 enzyme activity inhibitor and application thereof 科辉智药生物科技(无锡)有限公司 2024-03-22 CN disclosed
WO-2023185986-A1 BCL-XL INHIBITORS BEIGENE , LTD. (KY) 2023-10-05 WO disclosed
WO-2023125908-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEIGENE, LTD. (KY) 2023-07-06 WO disclosed
EP-4126844-A1 AMIDE COMPOUNDS AND USES THEREOF Hutchison Medipharma Limited (CN) 2023-02-08 EP disclosed
EP-4107154-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF Hutchison Medipharma Limited (CN) 2022-12-28 EP disclosed
CN-111909082-B Pyridine hydrazone derivatives, and preparation method and application thereof 湖南大学 2022-09-13 CN disclosed
WO-2021197276-A1 Amide compounds and uses thereof HUTCHISON MEDIPHARMA LIMITED (CN) 2021-10-07 WO disclosed
CN-1255386-C Substituted fused heterocyclic compound SANKYO CO (JP) 2006-05-10 CN disclosed
EP-1022272-B1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS SANKYO CO (JP) 2004-05-26 EP disclosed
US-6432993-B1 BENZIMIDAZOLE OR IMIDAZO(4,5-B)PYRIDINE DERIVATES; IMMUNOMODULATORS; ALDOSE REDUCTASE AND LIPOXYGENASE INHIBITORS; DIABETES; PREVENTS LIPID PEROXIDATION; ANTILIPEMIC, HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 2002-08-13 US disclosed
CN-1280570-A Substituted fused heterocyclic compounds SANKYO CO (JP) 2001-01-17 CN disclosed
EP-1022272-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS Sankyo Company Limited (JP) 2000-07-26 EP disclosed
US-4963686-A INTERMEDIATES FOR INOTROPIC AGENTS BOEHRINGER MANNHEIM GMBH (DE) 1990-10-16 US disclosed
EP-0154190-A1 Pyridones MERCK PATENT GmbH (DE) 1985-09-11 EP disclosed
US-4100283-A Growth promoting feed additive oxadiazines CIBA-GEIGY CORPORATION (US) 1978-07-11 US disclosed