SCHEMBL8583268

SCHEMBL8583268

O=P(O)(COS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
CFTR P13569 1/20 0.43
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38
CA1 P00915 2/20 0.38
CA4 P22748 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA5B Q9Y2D0 2/20 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
SCHEMBL8583278 0.94 TDP1 (0.47) TDP1CFTRENPP3ENPP1MEN1
SCHEMBL3149080 0.81 CA2 (0.47) TDP1MEN1KMT2AGAAFLT1
SCHEMBL8732756 0.80 TDP1 (0.42) TDP1MEN1KMT2ATP53GAA
SCHEMBL8730036 0.78 AOX1 (0.45) TDP1ENPP3ENPP1MEN1KMT2A
SCHEMBL28514304 0.77 MEN1 (0.54) TDP1ENPP3ENPP1MEN1KMT2A
SCHEMBL8758117 0.76 GAA (0.47) TDP1MEN1KMT2ATP53GAA
SCHEMBL8758194 0.75 L3MBTL1 (0.47) TDP1MEN1KMT2ATP53GAA
SCHEMBL28512466 0.74 CA12 (0.44) TDP1MEN1KMT2AGAACA12
SCHEMBL8729140 0.72 PKM (0.38) TDP1TP53GAAALDH1A1
SCHEMBL8730053 0.72 TDP1 (0.43) TDP1ENPP3ENPP1MEN1KMT2A

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
WO-1998022480-A1 PHOSPHORUS CONTAINING ARYLOXY OR ARYLTHIO PROPANOLAMINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1998-05-28 WO disclosed