SCHEMBL13986979

SCHEMBL13986979

O=C(NCCc1ccc(Cl)cc1)c1cc(-c2ccncc2)n[nH]c1=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.65
TP53 P04637 3/20 0.65
GSK3B P49841 2/20 0.56
GAA P10253 1/20 0.49
SCN2A Q99250 1/20 0.49
SCN10A Q9Y5Y9 1/20 0.49
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46

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
SCHEMBL13986963 0.90 GSK3B (0.56) MAPTTP53GSK3BGAALMNA
SCHEMBL13986970 0.89 GSK3B (0.53) MAPTTP53GSK3BGAALMNA
SCHEMBL13986986 0.89 GSK3B (0.66) MAPTTP53GSK3BGAALMNA
SCHEMBL13986961 0.89 GSK3B (0.55) MAPTTP53GSK3BGAALMNA
SCHEMBL4856682 0.89 GSK3B (0.69) MAPTTP53GSK3BLMNAKMT2A
SCHEMBL4851138 0.87 GSK3B (0.58) MAPTTP53GSK3BTDP1KMT2A
SCHEMBL13986962 0.86 CYP1A2 (0.55) MAPTTP53GSK3BKDM4EKMT2A
SCHEMBL13987015 0.85 KDM4E (0.56) MAPTGSK3BGAALMNAKDM4E
SCHEMBL13986947 0.84 GSK3B (0.56) MAPTTP53GSK3BGAAMAPK1
SCHEMBL13986976 0.84 P2RX7 (0.63) MAPTGSK3BGAALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7462613-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-09 US disclosed
US-7462613-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-09 US disclosed
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed