SCHEMBL8087689

SCHEMBL8087689

NC1(Cc2ccccc2)CCCCNC1=O

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.44
MAOB P27338 4/20 0.44
GRIN1 Q05586 3/20 0.38
GRIN2A Q12879 3/20 0.38
KMT2A Q03164 1/20 0.37
MMP2 P08253 4/20 0.37
MMP9 P14780 4/20 0.37
MMP8 P22894 4/20 0.37
MMP13 P45452 4/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
GRIN2B Q13224 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ADRB2 P07550 1/20 0.35
HTT P42858 1/20 0.35
DPP4 P27487 1/20 0.35
KDM1A O60341 2/20 0.35

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
SCHEMBL3244468 0.81 LMNA (0.44) KMT2AMMP2MMP9MMP8MMP13
Hydrochloric Acid SCHEMBL7097591 0.76 PSEN1 (0.32) GRIN1GRIN2AKMT2A
SCHEMBL24816477 0.76 MAOA (0.48) MAOAMAOBGRIN1GRIN2AKMT2A
SCHEMBL11558761 0.76 MAOA (0.48) MAOAMAOBGRIN1GRIN2AKMT2A
SCHEMBL24165068 0.74 CRBN (0.48) MAOAMAOBPDE4DDPP4KDM1A
SCHEMBL8083035 0.74 POLB (0.34) MAOAMAOBGRIN1GRIN2AKMT2A
SCHEMBL6730464 0.73 GRIN1 (0.43) MAOAMAOBGRIN1GRIN2AKMT2A
SCHEMBL31488213 0.73 LMNA (0.34) GRIN1GRIN2AHTT
SCHEMBL29048918 0.73 GRIN1 (0.40) MAOAMAOBGRIN1GRIN2AKMT2A
SCHEMBL6730223 0.71 GRIN1 (0.42) MAOAMAOBGRIN1GRIN2AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118994009-A Preparation method of mono-benzyl amino caprolactam, application thereof and functional nylon-6 中国石油化工股份有限公司 2024-11-22 CN claimed
CN-119638979-A Antibacterial nylon material and preparation method and application thereof 中国科学院长春应用化学研究所 2025-03-18 CN disclosed
CN-118994009-A Preparation method of mono-benzyl amino caprolactam, application thereof and functional nylon-6 中国石油化工股份有限公司 2024-11-22 CN disclosed
CN-118994009-A Preparation method of mono-benzyl amino caprolactam, application thereof and functional nylon-6 中国石油化工股份有限公司 2024-11-22 CN disclosed
CN-118994009-A Preparation method of mono-benzyl amino caprolactam, application thereof and functional nylon-6 中国石油化工股份有限公司 2024-11-22 CN disclosed
US-6034215-A 3-amino-2-oxo-1-piperidnercetic derivatives as enzyme inhibitors CORVAS INTERNATIONAL, INC. (US) 2000-03-07 US disclosed
US-5703208-A ANTICOAGULANTS CORVAS INTERNATIONAL, INC. (US) 1997-12-30 US disclosed
WO-1995035311-A9 3-AMINO-2-OXO-1-PIPERIDINEACETIC DERIVATIVES AS ENZYME INHIBITORS 1996-02-01 WO disclosed