SCHEMBL21155176

SCHEMBL21155176

O=S(=O)(O)c1cc(S(=O)(=O)c2ccc(Oc3ccc(-c4ccccc4)cc3)c(S(=O)(=O)O)c2)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.41
▸ RXFP1 Q9HBX9 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ BCL2L1 Q07817 2/20 0.39
▸ MCL1 Q07820 2/20 0.39
▸ ACLY P53396 2/20 0.39
▸ SCN9A Q15858 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KEAP1 Q14145 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 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
SCHEMBL18883311 0.89 SMN1; SMN2 (0.43) POLBRXFP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL26295068 0.87 HSD17B2 (0.41) POLBRXFP1SMN1; SMN2APEX1KDM4E
SCHEMBL17706660 0.86 POLB (0.41) POLBRXFP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL12780726 0.83 PKM (0.45) POLBRXFP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL12091348 0.83 MMP2 (0.48) POLBRXFP1SMN1; SMN2GAAHTT
SCHEMBL12190621 0.82 PKM (0.50) POLBGAAKEAP1NFE2L2KDM4E
SCHEMBL19391856 0.80 HTT (0.39) POLBRXFP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL12780764 0.80 PKM (0.51) POLBGAAKEAP1NFE2L2KDM4E
SCHEMBL26945108 0.79 HSD17B2 (0.38) POLBRXFP1SMN1; SMN2APEX1ALDH1A1
SCHEMBL12780798 0.79 PKM (0.58) POLBSMN1; SMN2GAAKDM4EMMP2

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
US-20190209973-A1 MULTILAYER HOLLOW FIBRE MEMBRANES BASF SE (DE) 2019-07-11 — — US disclosed
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