SCHEMBL29429129

SCHEMBL29429129

N#Cc1c2ccccc2c(C#N)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
KDM4E B2RXH2 3/20 0.64
MAPT P10636 2/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
GAA P10253 1/20 0.62
CACNA1B Q00975 1/20 0.62
APBA1 Q02410 1/20 0.62
TSHR P16473 2/20 0.45
EGFR P00533 1/20 0.43
SRC P12931 1/20 0.43
IMPDH2 P12268 3/20 0.41
IMPDH1 P20839 2/20 0.41
DYRK1A Q13627 2/20 0.39
PDE9A O76083 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL150623 1.00 ALDH1A1 (0.64) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL2546104 0.90 ALDH1A1 (0.59) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL148856 0.90 ALDH1A1 (0.59) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL16213053 0.89 TSHR (0.57) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL24617849 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL12495375 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL20549063 0.87 KDM4E (0.52) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL5751189 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL23625630 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL27914766 0.87 KDM4E (0.77) ALDH1A1KDM4EMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036720-A Synthesis method of key intermediate of trospium chloride 山东新时代药业有限公司 2026-05-15 CN claimed
CN-122036719-A Oxygen-mediated trospium chloride key intermediate microchannel synthesis method 山东新时代药业有限公司 2026-05-15 CN claimed
CN-119824435-A Method for preparing deuterated compound through Berch-type reduction reaction under condition of no transition metal and deuterated compound obtained by method 中国科学院理化技术研究所 2025-04-15 CN claimed
CN-119431100-A Method for regulating and controlling photon spin orbit coupling in organic alloy microcavity 河北大学 2025-02-14 CN claimed
CN-119409696-A Preparation method and application of 6-benzyl-1, 2,3, 4-tetrahydro-6H-pyrrolo [3,4-B ] pyridine-5, 7-dione 浙江新和成药业有限公司 2025-02-11 CN claimed
CN-114512719-B Eutectic solvent-based electrolyte and application thereof 中国科学院青岛生物能源与过程研究所 2024-12-03 CN claimed
CN-116217497-B Preparation method of 2-perfluoroalkyl quinazoline compound 昆明理工大学 2024-09-24 CN claimed
CN-118531524-A Organic micro-nano crystal-based large-area multicolor fluorescence emitting fiber and preparation method and application thereof 苏州大学 2024-08-23 CN claimed
CN-117051414-A Method for electrochemically synthesizing aryl sulfonyl fluoride compound 常州工学院 2023-11-14 CN claimed
CN-116925746-A Organic full-color micro-ring structural material based on surface tension auxiliary assembly and preparation method and application thereof 齐鲁工业大学(山东省科学院) 2023-10-24 CN claimed
CN-116217497-A Preparation method of 2-perfluoroalkyl quinazoline compound 昆明理工大学 2023-06-06 CN claimed
CN-115477666-A Luminescent molecular crystal based on boron-cyano interaction and preparation method thereof 北京师范大学 2022-12-16 CN claimed
CN-114512719-A Eutectic solvent-based electrolyte and application thereof 中国科学院青岛生物能源与过程研究所 2022-05-17 CN claimed
CN-122079776-A Method for synthesizing fulvestrant intermediate by utilizing pentafluoroethane photocatalysis and application thereof 2026-05-26 CN disclosed
CN-122036719-A Oxygen-mediated trospium chloride key intermediate microchannel synthesis method 山东新时代药业有限公司 2026-05-15 CN disclosed
CN-122036720-A Synthesis method of key intermediate of trospium chloride 山东新时代药业有限公司 2026-05-15 CN disclosed
CN-110337454-B Water-soluble composition, method for producing cured product thereof, and acylphosphinate 株式会社ADEKA 2022-04-12 CN disclosed
CN-109765652-B Composite retardation plate, optical laminate, and image display device 住友化学株式会社 2022-03-25 CN disclosed
CN-110461159-B Fungicidal compositions 先正达参股股份有限公司 2022-03-11 CN disclosed
CN-113979962-A Fungicidal compositions 先正达参股股份有限公司 2022-01-28 CN disclosed