SCHEMBL29463258

SCHEMBL29463258

NCc1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.71
MAOB P27338 5/20 0.65
IDO1 P14902 2/20 0.63
HTR2A P28223 1/20 0.61
HTR2C P28335 1/20 0.61
HTR2B P41595 1/20 0.61
ACP3 P15309 1/20 0.55
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
MIF P14174 2/20 0.53
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
KIF11 P52732 1/20 0.50
GRIN2B Q13224 1/20 0.50
PNMT P11086 1/20 0.50
EPHX1 P07099 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL39655 1.00 TAAR1 (0.71) TAAR1MAOBIDO1HTR2AHTR2C
Bromide SCHEMBL11233006 0.98 TAAR1 (0.69) TAAR1MAOBIDO1HTR2AHTR2C
Hydrochloric Acid SCHEMBL11220775 0.98 TAAR1 (0.69) TAAR1MAOBIDO1HTR2AHTR2C
Iodide SCHEMBL11221836 0.98 TAAR1 (0.69) TAAR1MAOBIDO1HTR2AHTR2C
Hydrochloric Acid SCHEMBL26616857 0.98 TAAR1 (0.69) TAAR1MAOBIDO1HTR2AHTR2C
Bromide SCHEMBL31513704 0.98 TAAR1 (0.69) TAAR1MAOBIDO1HTR2AHTR2C
Ethylamine SCHEMBL4238530 0.94 TAAR1 (0.65) TAAR1MAOBIDO1HTR2AHTR2C
SCHEMBL8107790 0.89 TAAR1 (0.59) TAAR1MAOBIDO1HTR2AHTR2C
SCHEMBL3727416 0.88 MAOB (0.61) TAAR1MAOBIDO1HTR2AHTR2C
Acetic Acid SCHEMBL29007023 0.88 TAAR1 (0.57) TAAR1MAOBIDO1HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119977906-A A-site cation-regulated halide perovskite, and preparation method and application thereof 西北大学 2025-05-13 CN claimed
CN-119899184-A Beta-carboline compound, preparation method thereof and application thereof in resisting Alzheimer disease 中国人民解放军北部战区总医院 2025-04-29 CN claimed
CN-119403792-A NO-releasing coating W.L.戈尔及同仁股份有限公司 2025-02-07 CN claimed
CN-118440274-A Preparation of stable porous organic polymer-based metal catalyst and application of catalyst in benzylamine dehydrogenation 中原工学院 2024-08-06 CN claimed
CN-111704575-B Synthesis method of quinoline-2-thiocarboxamide compound under conditions of no catalyst and no additive 衡阳师范学院 2023-06-09 CN claimed
EP-3122743-B1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AZEVAN PHARMACEUTICALS INC (US) 2022-11-09 EP claimed
EP-4735422-A1 SUBSTITUTED CYCLIC COMPOUNDS AND METHODS OF TREATING PHENYLKETONURIA AND OTHER AMINO ACIDURIAS Sanofi (FR) 2026-05-06 EP disclosed
WO-2025213277-A1 N1-(3,4-DICHLOROPHENYL)MALEAMIDE DERIVATIVES AND THE USE THEREOF IN THE TREATMENT OF INFLAMMATORY DISORDERS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2025-10-16 WO disclosed
WO-2025137551-A1 AMINE PURIFICATION IN A CARBON CAPTURE METHOD USING MOF BODIES SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2025-06-26 WO disclosed
CN-120136863-A Adrenergic receptor ADRAC2 antagonists 拜耳公司 2025-06-13 CN disclosed
CN-120025328-A Adrenergic receptor ADRAC2 antagonists 拜耳公司 2025-05-23 CN disclosed
CN-120025327-A Adrenergic receptor ADRAC2 antagonists 拜耳公司 2025-05-23 CN disclosed
CN-120000651-A Application of beta-carboline compounds in preparation of medicines for preventing and/or treating acute lung injury 中国人民解放军北部战区总医院 2025-05-16 CN disclosed
CN-114790176-A Imidazole compound and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-07-26 CN disclosed
CN-111065635-B Novel pyrimidine derivatives as MTH1 inhibitors 无锡安万生物科技有限公司 2022-07-22 CN disclosed
EP-4021905-A1 INHIBITORS OF ADRENORECEPTOR ADRAC2 Bayer Aktiengesellschaft (DE) 2022-07-06 EP disclosed
CN-114450277-A Substituted pyrimidines for the treatment and prevention of hepatitis B virus infection 豪夫迈·罗氏有限公司 2022-05-06 CN disclosed
CN-112313234-B Pyrazolo-triazolopyrimidine derivatives as A2A receptor antagonists 百济神州有限公司 2022-04-29 CN disclosed
CN-114302874-A Indole carboxamide derivatives and pharmaceutical compositions comprising same 国际药品株式会社 2022-04-08 CN disclosed
CN-114286711-A Bicyclic heterocyclic compounds as inhibitors of BCDIN3D activity 风暴治疗有限公司 2022-04-05 CN disclosed