SCHEMBL7396803

SCHEMBL7396803

Cc1cc(NS(=O)(=O)c2cccc([O])c2)cc(OCCN=Nc2ccncc2)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 0.56
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7334045 0.83 F2 (0.81) F2MEN1KMT2A
SCHEMBL8550080 0.72 F2 (1.00) F2
SCHEMBL8544350 0.70 F2 (0.83) F2
SCHEMBL8542916 0.69 F2 (0.76) F2
SCHEMBL8545960 0.69 F2 (0.72) F2
SCHEMBL8546663 0.68 F2 (0.84) F2
SCHEMBL7371793 0.68 F2 (0.86) F2MEN1KMT2ALMNAMAPT
SCHEMBL8542772 0.67 F2 (0.68) F2MEN1KMT2ALMNAGAA
SCHEMBL8542767 0.67 F2 (0.74) F2
SCHEMBL8546328 0.66 F2 (0.67) F2LMNA

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
EP-0687253-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME Roche Diagnostics GmbH (DE) 1995-12-20 EP disclosed
WO-1994020467-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1994-09-15 WO disclosed