SCHEMBL448133

SCHEMBL448133

Cc1cn[c]nc1

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
SCHEMBL12471092 0.67
SCHEMBL790735 0.65
SCHEMBL450323 0.65
SCHEMBL6292701 0.65
SCHEMBL533401 0.64
SCHEMBL6292671 0.64
SCHEMBL56855 0.64
SCHEMBL7325844 0.64
SCHEMBL2905432 0.63
SCHEMBL29291322 0.59 GRM5 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024149231-A1 PARP7 INHIBITORS AND USES THEREOF Angel Pharmaceutical Co., Ltd. (CN) 2024-07-18 WO claimed
WO-2024149234-A1 PARP7 INHIBITORS AND USES THEREOF Angel Pharmaceutical Co., Ltd. (CN) 2024-07-18 WO claimed
CN-114621209-B 1,2, 3-Thiadiazole acetonitrile derivatives, and preparation method and application thereof 南开大学 2024-06-14 CN claimed
EP-4370110-A1 COMPOUNDS, COMPOSITIONS AND METHODS Denali Therapeutics Inc. (US) 2024-05-22 EP claimed
CN-117940120-A Compounds, compositions, and methods 戴纳立制药公司 2024-04-26 CN claimed
US-20240034737-A1 Heterocyclic Derivatives as P2X7 Receptor Antagonists BREYE THERAPEUTICS APS (DK) 2024-02-01 US claimed
US-20240034728-A1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS, INC. 2024-02-01 US claimed
US-20230416205-A1 COMPOUNDS, COMPOSITIONS, AND METHODS TENVIE THERAPEUTICS, INC. 2023-12-28 US claimed
CN-114656462-B N-containing heterocyclic aromatic hydrazone derivatives, and preparation method and application thereof 南开大学 2023-12-19 CN claimed
CN-117157291-A Heterocyclic derivatives as P2X7 receptor antagonists 布雷耶疗法有限公司 2023-12-01 CN claimed
CN-1419450-A Nitrate salts of antimicrobial drugs NICOX SA (FR) 2003-05-21 CN claimed
EP-1253924-A1 NITRATE SALTS OF ANTIMICROBIAL AGENTS NICOX S.A. (FR) 2002-11-06 EP claimed
WO-2001054691-A1 NITRATE SALTS OF ANTIMICROBIAL AGENTS NICOX, S.A. (FR) 2001-08-02 WO claimed
US-5977110-A Substituted cyclohexylamines as central nervous systems agents WARNER-LAMBERT COMPANY (US) 1999-11-02 US claimed
WO-1997011070-A1 SUBSTITUTED CYCLOHEXYLAMINES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1997-03-27 WO claimed
EP-0096004-B1 SULFONYL(THIO)UREAS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR GROWTH REGULATING AGENTS CIBA-GEIGY AG (CH) 1989-04-26 EP claimed
EP-0096004-A2 Sulfonyl(thio)ureas, process for their preparation and their use as herbicides and/or growth regulating agents CIBA-GEIGY AG (CH) 1983-12-07 EP claimed
US-4333936-A Novel amidino-benzylpyrimidines, processes for their manufacture and antibacterial and antiprotozoal use thereof BASF AKTIENGESELLSCHAFT (DE) 1982-06-08 US claimed
EP-0000336-B1 N-BENZYLPYRIMIDINYL-AMIDINES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM BASF Aktiengesellschaft (DE) 1981-04-15 EP claimed
EP-0000336-A1 N-benzylpyrimidinyl-amidines, process for their preparation and medicines containing them BASF Aktiengesellschaft (DE) 1979-01-24 EP claimed