SCHEMBL7409794

SCHEMBL7409794

COc1ccccc1S(=O)(=O)N(CC(O)CO)c1cc(C)cc(OCCNc2ccnnc2)c1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.63
HPGD P15428 1/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8648601 0.94 F2 (0.59) F2HPGDLMNAHTTGAA
SCHEMBL7373800 0.93 F2 (0.54) F2HPGD
SCHEMBL7372831 0.93 F2 (0.54) F2HPGDLMNAHTT
SCHEMBL7372654 0.93 F2 (0.54) F2HPGDLMNAHTTGAA
SCHEMBL8664965 0.92 F2 (0.62) F2HPGD
SCHEMBL7412092 0.92 F2 (0.53) F2HPGDLMNAHTTGAA
SCHEMBL8648794 0.92 F2 (0.51) F2HPGD
SCHEMBL8649210 0.91 F2 (0.60) F2HPGDLMNAHTTGAA
SCHEMBL7374256 0.91 F2 (0.59) F2HPGDLMNAHTTGAA
SCHEMBL8650605 0.90 F2 (0.59) F2HPGDLMNAHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5795892-A ANTICOAGULANTS BOEHRINGER MANNEIM GMBH (DE) 1998-08-18 US disclosed
EP-0778829-A1 NOVEL 4-AMINOPYRIDAZINES, METHOD OF PREPARING THEM AND DRUGS CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1997-06-18 EP disclosed
WO-1996006832-A1 NOVEL 4-AMINOPYRIDAZINES, METHOD OF PREPARING THEM AND DRUGS CONTAINING THESE COMPOUNDS BOEHRINGER MANNHEIM GMBH (DE) 1996-03-07 WO disclosed