SCHEMBL2212441

SCHEMBL2212441

BrC1=CC=CC=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
Fluoride SCHEMBL28022526 0.95
SCHEMBL28166931 0.69
SCHEMBL446759 0.67
Hydrochloric Acid SCHEMBL28176836 0.67
SCHEMBL28267747 0.67
SCHEMBL6422365 0.65
SCHEMBL366678 0.65
Hydrochloric Acid SCHEMBL31508618 0.65
SCHEMBL2056747 0.65
SCHEMBL179728 0.65

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026032-A The manufacture method of optical activity 4- carbamoyl -2,6- 3,5-dimethylphenyl alanine derivatives 株式会社钟化 2018-05-11 CN claimed
CN-106164044-B Process for producing 1-arylimino-2-vinylcyclopropanecarboxylic acid derivative 株式会社钟化 2018-05-04 CN claimed
CN-106164044-A Process for producing 1-arylimino-2-vinylcyclopropanecarboxylic acid derivative 株式会社钟化 2016-11-23 CN claimed
CN-112969504-B Compounds for inhibiting alpha 4 beta 7 integrin 吉利德科学公司 2024-04-09 CN disclosed
CN-107848963-B Acid-resistant alkali-producing agent and/or radical-producing agent, and curable resin composition containing same 富士胶片和光纯药株式会社 2020-11-03 CN disclosed
CN-108047267-A Miscellaneous two ring [3.3.3] the hendecane compound of -5- bromines (hydrogen) of 1- azepine -5- germanium and its synthetic method 中国科学技术大学 2018-05-18 CN disclosed
CN-108026032-A The manufacture method of optical activity 4- carbamoyl -2,6- 3,5-dimethylphenyl alanine derivatives 株式会社钟化 2018-05-11 CN disclosed
CN-107849018-A Bridged piperazine derivatives 安斯泰来制药株式会社 2018-03-27 CN disclosed
CN-105403603-B A kind of preparation method and applications of optical electro-chemistry aptamers sensing electrode 江苏大学 2018-02-27 CN disclosed
CN-105073715-B The derovatives of dihydrogen dazin 3,5 中外制药株式会社 2017-12-01 CN disclosed
CN-104761578-B Based on rhodium tetraphenylporphyrin azepine fluorine boron two pyrroles's near infrared absorption phosphor material and its preparation method and purposes 南京大学 2017-03-08 CN disclosed
US-7982032-B2 reacting Dibenzo[b,f]azepine-5-carbonylchloride with alkali metal methoxide to yield 10-Methoxy-dibenz[b,f]azepine SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2011-07-19 US disclosed
US-20080269480-A1 Process for the Preparation of 10,11-Dihydro-10-Oxo-5H-Dibenz[B,F] Azepine-5-Carboxamide MUTHUKUMARAN MANDAKINI 2008-10-30 US disclosed
WO-2005096709-A2 A PROCESS FOR THE PREPARATION OF 10,11-DIHYDRO-10-OXO-5H-DIBENZ[B,F]AZEPINE-5-CARBOXAMIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2005-10-20 WO disclosed
CN-1009931-B The method for preparing glycerol ether phosphatides HOFFMANN LA ROCHE (CH) 1990-10-10 CN disclosed
CN-85103123-A The method for preparing glycerol ether phosphatides 1986-10-22 CN disclosed