SCHEMBL9376710

SCHEMBL9376710

O=S(=O)(c1ccccc1)c1cccc2scc(O)c12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ HTR6 P50406 6/20 0.42
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ FEN1 P39748 2/20 0.37
▸ ERCC5 P28715 1/20 0.37
▸ CA2 P00918 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ ERAP1 Q9NZ08 1/20 0.35
▸ NOX4 Q9NPH5 1/20 0.34

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
SCHEMBL29709995 0.72 POLB (0.66) POLBGAAGFERALDH1A1NPSR1
SCHEMBL12903976 0.72 HTR6 (0.57) POLBGAAGFERALDH1A1NPSR1
SCHEMBL312517 0.72 POLB (0.66) POLBGAAGFERALDH1A1NPSR1
SCHEMBL139251 0.71 POLB (0.55) POLBGAAGFERALDH1A1NPSR1
SCHEMBL28245930 0.69 POLB (0.53) POLBGAAGFERNPSR1HTR6
SCHEMBL9557407 0.69 ALDH1A1 (0.43) POLBGAAGFERALDH1A1NPSR1
SCHEMBL8080841 0.69 HTR6 (0.72) POLBGAAGFERALDH1A1NPSR1
SCHEMBL3145482 0.68 POLB (0.51) POLBGAAGFERNPSR1HTR6
SCHEMBL564663 0.68 HTR6 (0.58) POLBGAAGFERALDH1A1NPSR1
SCHEMBL28113141 0.68 POLB (0.51) POLBGAAGFERNPSR1HTR6

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-0382628-B1 Aminoalkoxylphenyl derivatives, process for their preparation and compositions containing them SANOFI ELF (FR) 1994-05-04 — — EP disclosed
EP-0382628-A1 Aminoalkoxylphenyl derivatives, process for their preparation and compositions containing them ELF SANOFI (FR) 1990-08-16 — — EP disclosed
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