SCHEMBL972555

SCHEMBL972555

NNC(=O)n1ccnc1

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
SCHEMBL30197806 0.82 L3MBTL1 (0.40)
SCHEMBL5202776 0.80
SCHEMBL14302183 0.79 MAPT (0.36)
SCHEMBL9285625 0.78
SCHEMBL22019922 0.78
SCHEMBL446876 0.78
SCHEMBL13262611 0.78
SCHEMBL13589000 0.78
SCHEMBL11398624 0.78 MAPT (0.37)
Hydrochloric Acid SCHEMBL5149348 0.77 MAPT (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107827880-B Carbonitrile compound containing imidazole and 1,3, 4-oxadiazole structure and preparation method and application thereof 浙江工业大学上虞研究院有限公司 2020-05-22 CN claimed
CN-107827880-A A kind of first nitrile compounds containing imidazoles and 1,3,4 oxadiazole structures and its preparation method and application 浙江工业大学上虞研究院有限公司 2018-03-23 CN claimed
EP-4382101-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS Eurofarma Laboratórios S.A. (BR) 2024-06-12 EP disclosed
CN-117567690-A temperature/pH dual-response chitosan/acidic polysaccharide hydrogel and preparation method and application thereof 大连市第二十四中学 2024-02-20 CN disclosed
EP-3885131-A1 OPTICAL LAMINATE LG CHEM, LTD. (KR) 2021-09-29 EP disclosed
CN-107827880-B Carbonitrile compound containing imidazole and 1,3, 4-oxadiazole structure and preparation method and application thereof 浙江工业大学上虞研究院有限公司 2020-05-22 CN disclosed
CN-107827880-A A kind of first nitrile compounds containing imidazoles and 1,3,4 oxadiazole structures and its preparation method and application 浙江工业大学上虞研究院有限公司 2018-03-23 CN disclosed
CN-107406436-A Oxinane yl-benzamide derivatives 伊莱利利公司 2017-11-28 CN disclosed
CN-102906093-B NK-3 receptor selective antagonists compound, pharmaceutical composition and the using method in the receptor-mediated disease of NK-3 EUROSCREEN S.A. (BE) 2016-01-13 CN disclosed
EP-2650287-B9 Thiazole Derivative and use thereof as VAP-1 Inhibitor R TECH UENO LTD (JP) 2015-08-05 EP disclosed
EP-2639229-B9 Thiazole Derivative and use thereof as VAP-1 Inhibitor R TECH UENO LTD (JP) 2015-08-05 EP disclosed
EP-2650287-A1 Thiazole Derivative and use thereof as VAP-1 Inhibitor R-Tech Ueno, Ltd. (JP) 2013-10-16 EP disclosed
EP-2639229-A2 Thiazole Derivative and use thereof as VAP-1 Inhibitor R-Tech Ueno, Ltd. (JP) 2013-09-18 EP disclosed
US-8507690-B2 Thiazole derivative and use thereof as VAP-1 inhibitor R-TECH UENO, LTD. (JP) 2013-08-13 US disclosed
CN-102906093-A Novel nk-3 receptor selective antagonist compounds, pharmaceutical composition and methods for use in nk-3 receptors mediated disorders EUROSCREEN SA 2013-01-30 CN disclosed
US-20110015240-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-01-20 US disclosed
CN-101932568-A Thiazole derivative and use thereof as vap-1 inhibitor R TECH UENO LTD 2010-12-29 CN disclosed
EP-2252604-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-Tech Ueno, Ltd. (JP) 2010-11-24 EP disclosed
WO-2009096609-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2009-08-06 WO disclosed
WO-2001027087-A2 PROCESS FOR MAKING BOC-PROTECTED 3-AMINOHYDANTOINS/THIOHYDANTOINS AND 3-AMINODIHYDROURACILS/DIHYDROTHIOURACILS THE PROCTER & GAMBLE COMPANY (US) 2001-04-19 WO disclosed