SCHEMBL6883439

SCHEMBL6883439

O=C(NC(NC(=O)NS(=O)(=O)C(F)(F)F)(c1ccccc1)c1ccccc1)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.39
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
CA5A P35218 1/20 0.38
CA9 Q16790 1/20 0.38
BRS3 P32247 1/20 0.38
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
ACP1 P24666 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NR1H3 Q13133 1/20 0.35
KAT6A Q92794 1/20 0.35
KCNN4 O15554 2/20 0.34
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33

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
SCHEMBL22503134 0.76 ACP1 (0.62) CA2CA1CA9MAPTKMT2A
SCHEMBL29770986 0.74 CA1 (0.50) PTPN1CA2CA1MAPTKMT2A
SCHEMBL22503298 0.73 KMT2A (0.50) CA2CA1CA5ACA9MAPT
SCHEMBL4964940 0.72 LMNA (0.62) CA2CA1CA5ACA9MAPT
SCHEMBL178335 0.72 HDAC3 (0.52) PTPN1CA1CA9MAPTKMT2A
SCHEMBL7044641 0.71 MEN1 (0.48) CA2CA1CA9KMT2AMEN1
SCHEMBL25708327 0.71 CA2 (0.52) PTPN1CA2CA1MAPK1SMN1; SMN2
SCHEMBL22503181 0.70 PTPN11 (0.51) PTPN1RAB9A
SCHEMBL9159682 0.69 KCNN4 (0.45) PTPN1MAPTKMT2AMEN1MAPK1
SCHEMBL14953624 0.69 CES1 (0.35) CA2CA1CA9KMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480836-A1 MIXTURE OF COLOUR DEVELOPERS Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed