SCHEMBL872341

SCHEMBL872341

O=C1C=NC2=NN=NC2=N1

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
SCHEMBL8620821 0.77
SCHEMBL215239 0.64
SCHEMBL10935127 0.64
SCHEMBL8618924 0.61 NOTUM (0.36)
SCHEMBL2346494 0.61
SCHEMBL220383 0.60
SCHEMBL8618626 0.58 NOTUM (0.39)
SCHEMBL7273937 0.57
SCHEMBL8158776 0.57
SCHEMBL1136777 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122031478-A Triazolopyrazine use of ketone compounds 昆明医科大学 2026-05-15 CN claimed
US-20040204347-A1 Treatment of demyelinating disorders EISAI CO., LTD. (JP) 2004-10-14 US claimed
JP-2002519373-A 2002-07-02 JP claimed
EP-1100504-A2 PHARMACEUTICAL COMPOSITIONS AND THEIR USES FOR TREATMENT OF DEMYELINATING DISORDERS Eisai Co., Ltd. (JP) 2001-05-23 EP claimed
WO-2000001376-A2 PHARMACEUTICAL COMPOSITIONS AND THEIR USES FOR TREATMENT OF DEMYELINATING DISORDERS EISAI CO., LTD (JP) 2000-01-13 WO claimed
CN-122031478-A Triazolopyrazine use of ketone compounds 昆明医科大学 2026-05-15 CN disclosed
CN-122031478-A Triazolopyrazine use of ketone compounds 昆明医科大学 2026-05-15 CN disclosed
CN-117447475-A Pyrazolo [4,3-b ] pyridines and imidazo [1,5-a ] pyrimidines as PDE1 inhibitors H.隆德贝克有限公司 2024-01-26 CN disclosed
EP-3529250-B1 IMIDAZOPYRAZINONES, PYRAZOLOPYRIMIDINONES AND PYRAZOLOPYRIDINONES AS PDE1 INHIBITORS H LUNDBECK AS (DK) 2023-12-06 EP disclosed
CN-111511742-B Pyrazolo [4,3-b ] pyridines and imidazo [1,5-a ] pyrimidines as PDE1 inhibitors H.隆德贝克有限公司 2023-10-27 CN disclosed
CN-111699188-B [1,2,4] triazolo [4,3-a ] pyrazin-8-one derivatives 伊莱利利公司 2023-09-22 CN disclosed
EP-3749671-B1 [1,2,4]TRIAZOLO[4,3-A]PYRAZIN-8-ONE DERIVATIVES LILLY CO ELI (US) 2023-03-29 EP disclosed
US-9073927-B2 Inhibitors of PI3 kinase FUNDACION CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2015-07-07 US disclosed
US-20130196986-A1 TRIAZOLOPYRAZINONES AS P2X7 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME CORP. 2013-08-01 US disclosed
EP-2619204-A2 TRIAZOLOPYRAZINONES AS P2X7 RECEPTOR ANTAGONISTS Merck Sharp & Dohme Corp. (US) 2013-07-31 EP disclosed
US-20130131057-A1 NEW BICYCLIC COMPOUNDS AS PI3-K AND MTOR INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO (ES) 2013-05-23 US disclosed
US-20130053371-A1 INHIBITORS OF PI3 KINASE CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2013-02-28 US disclosed
WO-2012040048-A2 TRIAZOLOPYRAZINONES AS P2X7 RECEPTOR ANTAGONISTS SCHERING CORPORATION (US) 2012-03-29 WO disclosed
WO-2011141713-A1 NEW BICYCLIC COMPOUNDS AS PI3-K AND MTOR INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2011-11-17 WO disclosed
WO-2011089400-A1 INHIBITORS OF PI3 KINASE CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2011-07-28 WO disclosed