SCHEMBL6550137

SCHEMBL6550137

O=S(=O)(/C=C\c1ccc(F)cc1)Cc1ccc(I)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
APP P05067 1/20 0.39
PKM P14618 1/20 0.38
HTR2A P28223 2/20 0.37
KCNH2 Q12809 2/20 0.37
GPR183 P32249 3/20 0.36
HSD11B1 P28845 1/20 0.36
NFE2L2 Q16236 2/20 0.35
PTGS1 P23219 1/20 0.35
FBP1 P09467 1/20 0.34
CYP2D6 P10635 1/20 0.34
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL5872255 1.00 KMT2A (0.46) KMT2AMEN1APPPKMHTR2A
SCHEMBL5871973 1.00 KMT2A (0.46) KMT2AMEN1APPPKMHTR2A
SCHEMBL5872250 1.00 KMT2A (0.46) KMT2AMEN1APPPKMHTR2A
SCHEMBL5871969 1.00 KMT2A (0.46) KMT2AMEN1APPPKMHTR2A
SCHEMBL1194500 0.92 KMT2A (0.51) KMT2AMEN1PKMHTR2AKCNH2
SCHEMBL1194433 0.92 KMT2A (0.51) KMT2AMEN1PKMHTR2AKCNH2
SCHEMBL1194436 0.92 KMT2A (0.51) KMT2AMEN1PKMHTR2AKCNH2
SCHEMBL1194446 0.84 KMT2A (0.63) KMT2AMEN1GPR183NFE2L2PTGS1
SCHEMBL5872228 0.84 APP (0.39) KMT2AMEN1APPLMNAMAPT
SCHEMBL1195026 0.84 KMT2A (0.63) KMT2AMEN1GPR183NFE2L2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1180024-B1 Z-STYRYL SULFONE ANTICANCER AGENTS UNIV TEMPLE (US) 2004-02-04 EP claimed
US-6576675-B1 Such as 4-fluorostyryl-4-iodobenzylsulfone; targeting receptor tyrosine kinases TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2003-06-10 US claimed
EP-1180024-A4 Z-STYRYL SULFONE ANTICANCER AGENTS UNIV TEMPLE (US) 2002-06-19 EP claimed
EP-1180024-A1 Z-STYRYL SULFONE ANTICANCER AGENTS Temple University of the Commonwealth System of Higher Education (US) 2002-02-20 EP claimed
WO-2000057872-A1 Z-STYRYL SULFONE ANTICANCER AGENTS TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2000-10-05 WO claimed
EP-1180024-B1 Z-STYRYL SULFONE ANTICANCER AGENTS UNIV TEMPLE (US) 2004-02-04 EP disclosed
US-6576675-B1 Such as 4-fluorostyryl-4-iodobenzylsulfone; targeting receptor tyrosine kinases TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2003-06-10 US disclosed
EP-1180024-A4 Z-STYRYL SULFONE ANTICANCER AGENTS UNIV TEMPLE (US) 2002-06-19 EP disclosed
EP-1180024-A1 Z-STYRYL SULFONE ANTICANCER AGENTS Temple University of the Commonwealth System of Higher Education (US) 2002-02-20 EP disclosed
WO-2000057872-A1 Z-STYRYL SULFONE ANTICANCER AGENTS TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2000-10-05 WO disclosed