SCHEMBL4637735

SCHEMBL4637735

O=S(=O)(NCc1ccc(Cl)nc1)c1cc(S(=O)(=O)c2ccccc2)ccc1CC(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.49
NAMPT P43490 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 2/20 0.47
PKM P14618 1/20 0.47
GAA P10253 2/20 0.44
LMNA P02545 2/20 0.43
SLC12A2 P55011 1/20 0.43
SLC12A5 Q9H2X9 1/20 0.43
SFRP1 Q8N474 5/20 0.42
GLA P06280 1/20 0.40
PDK1 Q15118 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK3 Q15120 1/20 0.38
PDK4 Q16654 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL4615976 0.86 SFRP1 (0.55) CYP2C9NAMPTMEN1KMT2ACYP2C19
SCHEMBL4637732 0.83 CYP2C9 (0.48) CYP2C9NAMPTMEN1KMT2ACYP2C19
SCHEMBL4637000 0.75 SFRP1 (0.56) KMT2AALDH1A1SFRP1CA1CA2
SCHEMBL6101796 0.70 SFRP1 (0.60) SFRP1
SCHEMBL4616485 0.70 SFRP1 (0.52) LMNASLC12A2SLC12A5SFRP1CA12
SCHEMBL4637484 0.68 SFRP1 (0.62) NAMPTALDH1A1SFRP1KDM4E
SCHEMBL4617728 0.68 LMNA (0.60) NAMPTLMNASFRP1
SCHEMBL4617999 0.68 SFRP1 (0.52) LMNASLC12A2SLC12A5SFRP1CA12
SCHEMBL4618553 0.66 SFRP1 (0.59) SFRP1
SCHEMBL2568189 0.66 ALDH1A1 (0.55) CYP2C9NAMPTMEN1KMT2AALDH1A1

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-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO disclosed