SCHEMBL8797922

SCHEMBL8797922

O=C1NC(=O)C(=Cc2ccc(OCCN3COc4ccc(Cl)cc4C3=O)cc2)S1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.52
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49
PIM1 P11309 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
CISD1 Q9NZ45 2/20 0.48
HRH3 Q9Y5N1 1/20 0.48
FLT3 P36888 1/20 0.47
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47
NCSTN Q92542 1/20 0.47
APH1A Q96BI3 1/20 0.47
PSENEN Q9NZ42 1/20 0.47
LRRK2 Q5S007 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47

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
SCHEMBL8797917 1.00 HPGD (0.52) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8797928 0.91 PSEN1 (0.44) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8797670 0.89 HPGD (0.52) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8797673 0.89 HPGD (0.52) HPGDMAOAMAOBPIM1PIM2
SCHEMBL7454718 0.87 MGAM (0.58) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8796772 0.87 MGAM (0.58) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8798469 0.86 HPGD (0.49) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8798466 0.86 HPGD (0.49) HPGDMAOAMAOBPIM1PIM2
SCHEMBL8796662 0.84 PSEN1 (0.42) HPGDMAOAMAOBFLT3PSEN1
SCHEMBL8797738 0.83 HPGD (0.52) HPGDMAOAMAOBPIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787727-A1 Benzoazine derivative or salt thereof and pharmaceutical composition comprising the same SS Pharmaceutical Co., Ltd. (JP) 1997-08-06 EP disclosed