SCHEMBL459814

SCHEMBL459814

CCc1ccc(Br)nn1

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
Bromide SCHEMBL20588820 0.98 GABRA1 (0.31)
SCHEMBL45848 0.84 TP53 (0.33)
SCHEMBL10841047 0.81 CYP19A1 (0.33)
SCHEMBL25642289 0.78 KCNH2 (0.39)
SCHEMBL26454386 0.77 CCR1 (0.42)
SCHEMBL24468092 0.76 CCR4 (0.31)
SCHEMBL10843796 0.76 KCNH2 (0.47)
SCHEMBL8230350 0.75
SCHEMBL24468408 0.75 KDM4E (0.33)
SCHEMBL610831 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250332155-A1 SUBSTITUTED TETRAHYDROQUINOLINONE COMPOUNDS AS ROR GAMMA MODULATORS AURIGENE ONCOLOGY LTD (IN) 2025-10-30 US disclosed
US-12377088-B2 Substituted tetrahydroquinolinone compounds as ROR gamma modulators AURIGENE ONCOLOGY LIMITED (IN) 2025-08-05 US disclosed
EP-3526216-B1 BENZOTHIAZOLE DERIVATIVES AS DYRK1 INHIBITORS PHARMASUM THERAPEUTICS AS (NO) 2024-04-03 EP disclosed
US-20230331676-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF HENAN RADIOMEDICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-10-19 US disclosed
US-20230331676-A1 NAPHTHYLUREA COMPOUND, METHODS OF PREPARATION AND USE THEREOF HENAN RADIOMEDICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-10-19 US disclosed
CN-109843879-B Benzothiazole derivatives as DYRK1 inhibitors 药物治疗股份有限公司 2023-05-02 CN disclosed
US-20220125780-A1 SUBSTITUTED TETRAHYDROQUINOLINONE COMPOUNDS AS ROR GAMMA MODULATORS AURIGENE ONCOLOGY LIMITED (IN) 2022-04-28 US disclosed
US-11229636-B2 Substituted tetrahydroquinolinone compounds as ROR gamma modulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-01-25 US disclosed
CN-113121497-A Substituted tetrahydroquinolinone compounds as ROR gamma modulators 奥瑞基尼探索技术有限公司 2021-07-16 CN disclosed
EP-3845526-A1 METHOD FOR THE PREPARATION OF TETRAHYDROQUINOLINONE COMPOUNDS HAVING ROR-GAMMA MODULATING ACTIVITY Aurigene Discovery Technologies Limited (IN) 2021-07-07 EP disclosed
CN-104119394-A Blue organic electrophosphorescent material iridium metal complex, preparation method thereof and organic electroluminescent device OCEANS KING LIGHTING SCIENCE 2014-10-29 CN disclosed
US-20140221377-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL MYERS SQUIBB CO (US) 2014-08-07 US disclosed
US-8642585-B2 Indanyloxydihydrobenzofuranylacetic acids BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-04 US disclosed
WO-2013144098-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 WO disclosed
WO-2013144097-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 WO disclosed
US-20130252937-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-09-26 US disclosed
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed
US-7863291-B2 Quinuclidine compounds as alpha-7 nicotinic acetylcholine receptor ligands BRISTOL-MYERS SQUIBB COMPANY (US) 2011-01-04 US disclosed
US-20090270405-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY 2009-10-29 US disclosed
US-5242924-A Tetrazolyl-(phenoxy and phenoxyalkyl)-piperidinylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1993-09-07 US disclosed