SCHEMBL8548264

SCHEMBL8548264

O=S(=O)(c1cc(Cl)cc(NCCNc2ccncc2)c1)N(Cc1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.57
F2 P00734 3/20 0.54
NAMPT P43490 1/20 0.52
PGR P06401 2/20 0.47
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
POLB P06746 1/20 0.46
S1PR1 P21453 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ESR1 P03372 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
NR3C1 P04150 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 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
SCHEMBL8548218 0.86 NAMPT (0.56) PKMF2NAMPTMEN1KMT2A
SCHEMBL8545802 0.86 F2 (0.75) PKMF2NAMPTPGRNR3C1
SCHEMBL7334051 0.81 MEN1 (0.54) PKMNAMPTPGRMEN1KMT2A
SCHEMBL27336362 0.81 GAA (0.52) F2PGRMEN1KMT2AESR1
SCHEMBL8548009 0.78 F2 (0.64) PKMF2NAMPTPGRPOLB
SCHEMBL7364438 0.76 F2 (0.67) PKMF2PGR
SCHEMBL8547842 0.76 F2 (0.67) F2NAMPTPGRNR3C1ALDH1A1
SCHEMBL8549652 0.74 ESR1 (0.66) PKMPGRMEN1KMT2AS1PR1
SCHEMBL8544327 0.74 PGR (0.56) PKMPGRMEN1KMT2AS1PR1
SCHEMBL8542813 0.74 F2 (0.73) PKMF2NR3C1MAPT

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