SCHEMBL6956103

SCHEMBL6956103

Cc1ccccc1NCc1ccc2cc(C=C3SC(=O)NC3=O)cnc2c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
HDAC4 P56524 10/20 0.44
HDAC8 Q9BY41 6/20 0.44
PIM1 P11309 3/20 0.44
PIM2 Q9P1W9 3/20 0.44
IGF1R P08069 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
PPARG P37231 3/20 0.43
TTR P02766 1/20 0.43
HPGD P15428 1/20 0.42
PIM3 Q86V86 1/20 0.42
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL6958953 0.79 ADRA2C (0.45) HDAC8ALDH1A1GAAMAPTHPGD
SCHEMBL6956099 0.79 PPARG (0.52) MAOAMAOBHDAC4HDAC8PIM1
SCHEMBL6956100 0.79 PPARG (0.52) MAOAMAOBHDAC4HDAC8PIM1
SCHEMBL1249852 0.77 GSK3B (0.60) MAOAMAOBPIM1PIM2GAA
SCHEMBL1249857 0.77 GSK3B (0.60) MAOAMAOBPIM1PIM2GAA
SCHEMBL6964870 0.74 ALDH1A1 (0.44) MAOAMAOBALDH1A1PPARG
SCHEMBL6958325 0.72 ADRA2C (0.46) HDAC8ALDH1A1GAAMAPTNPC1
SCHEMBL8824925 0.70 GAA (0.38) HDAC8GAAMAPTNPC1RAB9A
SCHEMBL8825048 0.70 GSK3A (0.43) HDAC8PIM1ALDH1A1GAAMAPT
SCHEMBL6960815 0.70 HPGDS (0.47) MAOBHDAC8HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
US-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed