SCHEMBL8548009

SCHEMBL8548009

O=S(=O)(c1ccccc1)N(Cc1ccccc1)c1cc(Cl)cc(OCCNc2ccncc2)c1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.64
PKM P14618 1/20 0.53
PGR P06401 2/20 0.45
NR3C1 P04150 2/20 0.44
POLB P06746 1/20 0.44
NAMPT P43490 1/20 0.43

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
SCHEMBL8545802 0.91 F2 (0.75) F2PKMPGRNR3C1NAMPT
SCHEMBL8543114 0.89 F2 (0.62) F2PKMNR3C1POLB
SCHEMBL8542813 0.87 F2 (0.73) F2PKMNR3C1
SCHEMBL7364438 0.83 F2 (0.67) F2PKMPGR
SCHEMBL7334961 0.83 MAPT (0.62) PKMNR3C1POLBNAMPT
SCHEMBL8547842 0.81 F2 (0.67) F2PGRNR3C1NAMPT
SCHEMBL8548264 0.78 PKM (0.57) F2PKMPGRNR3C1POLB
SCHEMBL8546878 0.78 F2 (1.00) F2
SCHEMBL8548135 0.77 F2 (0.61) F2
SCHEMBL8547659 0.77 F2 (0.67) 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 1 patent. 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