SCHEMBL8562544

SCHEMBL8562544

CN(NC1=CC(=O)NCC1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.35
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
GFER P55789 1/20 0.34
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PARP10 Q53GL7 3/20 0.31
PARP11 Q9NR21 3/20 0.31
PDPK1 O15530 1/20 0.31
PARP1 P09874 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
PTPN1 P18031 1/20 0.30
CES1 P23141 1/20 0.30
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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
SCHEMBL8562063 0.72 ALDH1A1 (0.41) HPGDALDH1A1GAAMAPTGFER
SCHEMBL22650411 0.70
SCHEMBL7288077 0.69 ADRA2B (0.45) HPGDALDH1A1GAAMAPTHTT
SCHEMBL29892345 0.69 HPGD (0.54) HPGDALDH1A1GAAMAPTHTT
SCHEMBL7283649 0.66 ALDH1A1 (0.48) HPGDALDH1A1GAAMAPTHTT
SCHEMBL22650909 0.64 CRBN (0.38) HPGDPARP10PARP11PARP1
SCHEMBL7287173 0.64 PARP10 (0.41) PARP10PARP11PIM1
SCHEMBL2744596 0.63 RAB9A (0.44) ALDH1A1HTTMEN1KMT2AHTR2B
Hydrochloric Acid SCHEMBL28078944 0.62 RAB9A (0.42) ALDH1A1HTTMEN1KMT2AHTR2B
SCHEMBL797238 0.61 ALDH1A1 (0.45) HPGDALDH1A1GAAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106452100-A Three-level photovoltaic grid-connected inverter based on DSP control and working method of three-level photovoltaic grid-connected inverter 江苏建筑职业技术学院 2017-02-22 CN claimed
CN-106452100-A Three-level photovoltaic grid-connected inverter based on DSP control and working method of three-level photovoltaic grid-connected inverter 江苏建筑职业技术学院 2017-02-22 CN disclosed
EP-0458624-B1 Process for the preparation of lactam derivatives GLAXO GROUP LTD (GB) 1998-04-01 EP disclosed
US-5196534-A PROCESS FOR THE PREPARATION OF LACTAM DERIVATIVES GLAXO GROUP LIMITED (GB) 1993-03-23 US disclosed
EP-0458624-A1 Process for the preparation of lactam derivatives GLAXO GROUP LIMITED (GB) 1991-11-27 EP disclosed