SCHEMBL1171018

SCHEMBL1171018

O=Cn1ccnn1

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
Hydrochloric Acid SCHEMBL27646877 0.97
Hydrochloric Acid SCHEMBL27889815 0.97
Hydrochloric Acid SCHEMBL27692681 0.95
SCHEMBL14384895 0.72
SCHEMBL7007121 0.72
SCHEMBL9015530 0.72
SCHEMBL27709112 0.72
SCHEMBL9830721 0.69
SCHEMBL9830712 0.69
SCHEMBL4788392 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof APOGEE PHARMACEUTICALS, INC. (CA) 2025-08-05 US claimed
CN-117209438-A Preparation method of 1,2,4 triazole-3-ketone compound 五邑大学 2023-12-12 CN claimed
US-20230357578-A1 AIRTIGHT FILM WITH CERAMIC SEALING LAYER AND POLYMER SEALING LAYER Quantum MicroMaterials, Inc. 2023-11-09 US claimed
CN-113214240-B N-formamido pyrazoline derivative as P2X3 receptor antagonist and application thereof 杭州维坦医药科技有限公司 2022-12-06 CN claimed
EP-3856178-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2021-08-04 EP claimed
WO-2020065613-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 WO claimed
CN-110520414-A Substituted N- (-1,3, 4-oxadiazol-2-yl) arylcarboxamides and their use as herbicides BAYER CROPSCIENCE AG 2019-11-29 CN claimed
CN-109776437-A A kind of preparation method of new sulfentrazone 江苏中旗科技股份有限公司 2019-05-21 CN claimed
CN-109748878-A A kind of sulfentrazone key intermediate benzene connects the preparation method of triazolinones derivative 江苏中旗科技股份有限公司 2019-05-14 CN claimed
CN-109485613-A Preparation method of aprepitant and fosaprepitant side chain fragments 海门慧聚药业有限公司 2019-03-19 CN claimed
CN-1237172-A 2R, 4S, R, S- and 2S, 4R, R, S-hydroxyitraconazole and hydroxysaperconazole SEPRACOR INC (US) 1999-12-01 CN claimed
CN-1237173-A 2R, 4S, R, R- and 2S, 4R, R, R-hydroxyitraconazole SEPRACOR INC (US) 1999-12-01 CN claimed
CN-1227051-A Selective herbicide for sugarcane cultivation BAYER AG (DE) 1999-09-01 CN claimed
CN-1198159-A sulphonylamino (thio) carbonyl compounds 拜尔公司 1998-11-04 CN claimed
CN-1170363-A Remedy for ischemic diseases CHUGAI PHARMACEUTICAL CO LTD (JP) 1998-01-14 CN claimed
WO-1996000219-A1 PYRIMIDINYL- AND TRIAZINYL-OXY AND THIO-3-HALOALKYL-PROPIONIC ACID DERIVATIVES AS HERBICIDES CIBA-GEIGY AG (CH) 1996-01-04 WO claimed
CN-1092769-A Cyclic urea derivatives, the method that contains the pharmaceutical composition of these compounds and prepare them THOMAE GMBH DR K (DE) 1994-09-28 CN claimed
EP-0163895-B1 PROCESS FOR THE DIASTEREOSELECTIVE REDUCTION OF ALPHA-TRIAZOLYL KETONES TO BETA-TRIAZOLYL CARBINOLS BASF Aktiengesellschaft (DE) 1989-04-12 EP claimed
EP-0080102-B1 CYCLOALKYL-(ALPHA-TRIAZOLYL-BETA-HYDROXY) KETONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES AND PLANT GROWTH REGULATORS BAYER AG (DE) 1986-05-28 EP claimed
EP-0080102-A1 Cycloalkyl-(alpha-triazolyl-beta-hydroxy) ketones, process for their preparation and their use as fungicides and plant growth regulators BAYER AG (DE) 1983-06-01 EP claimed