SCHEMBL4074645

SCHEMBL4074645

[C]1=Cc2ccccc2-c2ccccc2N1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
PDGFRA P16234 1/20 0.30
FER P16591 1/20 0.30
LTK P29376 1/20 0.30
CDK8 P49336 1/20 0.30
ACVR1 Q04771 1/20 0.30
LRRK2 Q5S007 1/20 0.30
DYRK1B Q9Y463 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
SCHEMBL194389 0.68 RAD52 (0.36) GAAMAPT
SCHEMBL3103996 0.68 MEN1 (0.33) MAPTMAOAMAOB
SCHEMBL1383598 0.64 MAOA (0.32) MAOAMAOBPDGFRAFERLTK
SCHEMBL131587 0.64 GAA (0.37) GAAMAPT
SCHEMBL156862 0.62 MAPT (0.41) GAAMAPTMAOAMAOBPDGFRA
SCHEMBL29353131 0.62 MAPT (0.41) GAAMAPTMAOAMAOBPDGFRA
SCHEMBL1618358 0.61 MAOA (0.42) GAAMAPTMAOAMAOBPDGFRA
SCHEMBL8780 0.61 GAA (0.34) GAAMAPTMAOAMAOBPDGFRA
SCHEMBL207759 0.61 GAA (0.44) GAAMAPT
SCHEMBL2514534 0.60 LMNA (0.31) GAAMAPT

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
US-7566707-B2 Imidazopyridazinone and imidazopyridone derivatives, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-07-28 US claimed