SCHEMBL7329074

SCHEMBL7329074

O=S(=O)(Nc1cccc(OCCNc2ccncc2)c1)c1ccccc1Cl

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F2 P00734 18/20 0.73
PGR P06401 1/20 0.46
FABP1 P07148 1/20 0.45

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
SCHEMBL8542796 0.87 F2 (0.74) F2
SCHEMBL8546329 0.86 F2 (0.73) F2PGRFABP1
SCHEMBL7333772 0.85 F2 (0.74) F2FABP1
SCHEMBL8543078 0.84 F2 (1.00) F2FABP1
Hydrochloric Acid SCHEMBL8543551 0.83 F2 (0.98) F2
SCHEMBL8544836 0.81 F2 (1.00) F2PGR
Hydrochloric Acid SCHEMBL8542002 0.81 F2 (0.98) F2
SCHEMBL7337386 0.80 F2 (1.00) F2
SCHEMBL7329820 0.80 F2 (0.75) F2PGR
SCHEMBL8544231 0.80 F2 (1.00) 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