SCHEMBL7328144

SCHEMBL7328144

Cc1cc(OCCNc2ccncc2)cc(OS(=O)(=O)c2cccc(OCC(=O)NCCO)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 16/20 0.56
GALR3 O60755 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARD Q03181 1/20 0.42

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
SCHEMBL8546328 0.88 F2 (0.67) F2
SCHEMBL8541190 0.81 F2 (0.72) F2
SCHEMBL8543458 0.78 F2 (0.62) F2
SCHEMBL8646505 0.78 F2 (0.47) F2
SCHEMBL8548020 0.76 F2 (0.68) F2
SCHEMBL8542916 0.76 F2 (0.76) F2
SCHEMBL7332328 0.76 F2 (0.74) F2
SCHEMBL8548384 0.76 F2 (0.62) F2MEN1KMT2A
SCHEMBL7334269 0.75 LMNA (0.59) GALR3HSP90AA1MEN1KMT2A
SCHEMBL8545960 0.75 F2 (0.72) F2

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
EP-0687253-B1 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1998-12-16 EP disclosed
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