SCHEMBL13986929

SCHEMBL13986929

C[Si](C)(C)CCOCOc1ccc(CN)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
MAOB P27338 15/20 0.45
ST14 Q9Y5Y6 1/20 0.40
TP53 P04637 1/20 0.35
MDM2 Q00987 1/20 0.35

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
SCHEMBL4050696 0.83 TP53 (0.33) KEAP1NFE2L2TP53MDM2
SCHEMBL5281505 0.83 HRH3 (0.40) TP53MDM2
SCHEMBL6041849 0.83 TDP1 (0.33) KEAP1NFE2L2TP53MDM2
SCHEMBL16241937 0.83 TP53 (0.35) TP53MDM2
SCHEMBL15516640 0.82 TDP1 (0.48) NFE2L2MAOB
SCHEMBL2471286 0.79 KDM4E (0.41) MAOB
SCHEMBL11889100 0.79 LTA4H (0.46)
SCHEMBL292142 0.79 TP53 (0.32) TP53MDM2
SCHEMBL8216043 0.78 KCNA3 (0.46)
SCHEMBL22198886 0.77 MTNR1A (0.40) TP53

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