SCHEMBL9855503

SCHEMBL9855503

O=C(O)c1ccc(S(=O)(=O)c2ccc(Oc3ccc(S(=O)(=O)c4ccc(C(=O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.76
APEX1 P27695 2/20 0.76
CTDSP1 Q9GZU7 1/20 0.76
L3MBTL1 Q9Y468 1/20 0.76
PARP15 Q460N3 1/20 0.60
PARP10 Q53GL7 1/20 0.60
SRD5A2 P31213 4/20 0.58
GFER P55789 1/20 0.56
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PTGES O14684 2/20 0.54
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA12 O43570 1/20 0.53
CA3 P07451 1/20 0.53
CA6 P23280 1/20 0.53
CYP2C19 P33261 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53

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
SCHEMBL1634512 1.00 POLB (0.76) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL11050987 1.00 POLB (0.76) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL8899960 0.94 POLB (0.69) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL7822703 0.91 POLB (0.66) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL8827158 0.90 POLB (0.68) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL5581302 0.87 CA1 (0.67) POLBAPEX1CTDSP1L3MBTL1SRD5A2
SCHEMBL22349 0.87 CA1 (0.67) POLBAPEX1CTDSP1L3MBTL1SRD5A2
SCHEMBL2917437 0.87 CA1 (0.67) POLBAPEX1CTDSP1L3MBTL1SRD5A2
SCHEMBL15708520 0.87 APEX1 (1.00) POLBAPEX1CTDSP1L3MBTL1PARP15
SCHEMBL8899969 0.87 POLB (0.61) POLBAPEX1CTDSP1L3MBTL1PARP15

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-0255384-B1 4,4-BIS-(CARBOXYPHENYLSULFONYL)DIPHENYL ETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE Tonen Corporation (JP) 1991-10-16 EP disclosed
EP-0255384-A1 4,4-bis-(carboxyphenylsulfonyl)diphenyl ethers, process for their preparation and their use Tonen Corporation (JP) 1988-02-03 EP disclosed