SCHEMBL7364438

SCHEMBL7364438

O=S(=O)(c1cccc(OCCNc2ccncc2)c1)N(Cc1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 16/20 0.67
PGR P06401 2/20 0.52
CYP11B1 P15538 1/20 0.52
PKM P14618 1/20 0.48

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
SCHEMBL8542813 0.94 F2 (0.73) F2PKM
SCHEMBL8547842 0.87 F2 (0.67) F2PGRCYP11B1
SCHEMBL8545802 0.87 F2 (0.75) F2PGRPKM
SCHEMBL8547209 0.85 F2 (0.88) F2PGR
SCHEMBL8548009 0.83 F2 (0.64) F2PGRPKM
SCHEMBL8543114 0.83 F2 (0.62) F2PKM
SCHEMBL8540792 0.83 F2 (0.78) F2
SCHEMBL8541350 0.81 F2 (0.75) F2
SCHEMBL8547694 0.81 F2 (1.00) F2
SCHEMBL8549781 0.80 F2 (0.71) 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