SCHEMBL13986980

SCHEMBL13986980

O=C(NCCc1c[nH]c2ccc(Cl)cc12)c1cc(-c2ccncc2)n[nH]c1=O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SNCA P37840 12/20 0.60
HPGD P15428 1/20 0.57
PTGS1 P23219 2/20 0.54
PTGS2 P35354 1/20 0.54
MAPT P10636 1/20 0.54
MTNR1A P48039 1/20 0.53
MTNR1B P49286 1/20 0.53
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
MMP14 P50281 1/20 0.52
TSHR P16473 1/20 0.51
GSK3B P49841 1/20 0.50

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
SCHEMBL13986969 0.89 GAA (0.57) SNCAHPGDPTGS1PTGS2MAPT
SCHEMBL13986973 0.88 SIRT1 (0.56) PTGS1PTGS2GSK3B
SCHEMBL14374752 0.88 SNCA (0.49) SNCAHPGDPTGS1PTGS2MAPT
SCHEMBL13987008 0.87 KMT2A (0.59) HPGDPTGS1PTGS2MTNR1AMTNR1B
SCHEMBL4851138 0.86 GSK3B (0.58) MAPTGSK3B
SCHEMBL13986979 0.81 MAPT (0.65) MAPTGSK3B
SCHEMBL13986972 0.81 MTNR1A (0.56) HPGDPTGS1PTGS2MAPTMTNR1A
SCHEMBL13986976 0.81 P2RX7 (0.63) HPGDMAPTGSK3B
SCHEMBL9936292 0.81 SNCA (0.81) SNCAHPGDMAPT
SCHEMBL9936203 0.78 HPGD (0.73) SNCAHPGDMAPT

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 2 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-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed