SCHEMBL29493545

SCHEMBL29493545

Nc1c(Br)cnc(Br)c1N

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA3 P07451 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL727843 1.00 HTT (0.42) HTTKMT2AGAAMAPTCA1
SCHEMBL18803134 0.81 HTT (0.41) HTTKMT2AGAAMAPT
SCHEMBL23647988 0.77 HTT (0.38) HTTKMT2A
SCHEMBL19229126 0.77 HTT (0.38) HTTKMT2A
SCHEMBL19229125 0.77 HTT (0.38) HTTKMT2A
SCHEMBL30206252 0.74 KDM4E (0.39) HTTKMT2AGAAMAPTCA1
SCHEMBL29354307 0.74 ALDH1A1 (0.36) HTTKMT2AGAAMAPTCA1
SCHEMBL29173696 0.74 KDM4E (0.39) HTTKMT2AGAAMAPTCA1
SCHEMBL3487390 0.74 ALDH1A1 (0.36) HTTKMT2AGAAMAPTCA1
SCHEMBL18232339 0.72 TBK1 (0.38) HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114456355-B Double-pyridine triazole semiconductor polymer and preparation and application thereof 中国科学院化学研究所 2023-03-24 CN claimed
CN-114456355-A Double-pyridine triazole semiconductor polymer and preparation and application thereof 中国科学院化学研究所 2022-05-10 CN claimed
CN-114409682-A Triazole pyridine receptor with positioning effect, polymer thereof and application thereof 中国科学院化学研究所 2022-04-29 CN claimed
WO-2026101098-A1 DICHROIC DYE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL CELL, AND LIQUID CRYSTAL DISPLAY DEVICE 주식회사 엘지화학 2026-05-15 WO disclosed
CN-120040445-A Heterocyclopyridine-7-one compound and medical application thereof 浙江大学金华研究院 2025-05-27 CN disclosed
CN-113923988-B Substituted arylmethyl ureas and heteroarylmethyl ureas, analogs thereof, and methods of using the same 爱彼特生物制药公司 2024-12-13 CN disclosed
EP-4373817-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER Astrazeneca AB (SE) 2024-05-29 EP disclosed
WO-2024105563-A1 SUBSTITUTED BICYCLIC PYRIDONE DERIVATIVES PFIZER INC. (US) 2024-05-23 WO disclosed
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 CN disclosed
CN-117327075-A Bicyclic compounds as allosteric SHP2 inhibitors 锐新医药公司 2024-01-02 CN disclosed
CN-110446709-B Bicyclic compounds as allosteric SHP2 inhibitors 锐新医药公司 2023-09-12 CN disclosed
EP-4175957-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS Purdue Research Foundation (US) 2023-05-10 EP disclosed
CN-114456355-B Double-pyridine triazole semiconductor polymer and preparation and application thereof 中国科学院化学研究所 2023-03-24 CN disclosed
WO-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 WO disclosed
CN-110655639-B Segmented copolymer containing pyridine heterocyclic unit and preparation method and application thereof 华南理工大学 2022-07-26 CN disclosed
CN-114456355-A Double-pyridine triazole semiconductor polymer and preparation and application thereof 中国科学院化学研究所 2022-05-10 CN disclosed
CN-114409682-A Triazole pyridine receptor with positioning effect, polymer thereof and application thereof 中国科学院化学研究所 2022-04-29 CN disclosed
CN-110655653-B A-D-A type polymer with main chain containing metal element, preparation method and application thereof 华南理工大学 2022-04-22 CN disclosed
CN-114195781-A Pyridopyrazine compound and preparation method and application thereof 安徽秀朗新材料科技有限公司 2022-03-18 CN disclosed