SCHEMBL8960439

SCHEMBL8960439

O=S(=O)(c1ccc(O)cc1)c1cc2ccccc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.56
AKR1B1 P15121 1/20 0.50
FLT3 P36888 2/20 0.45
PDGFRB P09619 1/20 0.45
PDGFRA P16234 1/20 0.45
DAO P14920 2/20 0.45
DDO Q99489 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA9 Q16790 1/20 0.44
CNR1 P21554 2/20 0.43
BCAT1 P54687 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
SRD5A2 P31213 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CCKAR P32238 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL31561597 0.86 CA2 (0.62) CA2AKR1B1FLT3DAOCA12
SCHEMBL3237494 0.86 CA2 (0.62) CA2AKR1B1FLT3DAOCA12
SCHEMBL30684143 0.84 CA2 (0.56) CA2AKR1B1PDGFRBPDGFRACA12
SCHEMBL4862702 0.84 CA2 (0.56) CA2AKR1B1CA12CA1CA9
SCHEMBL670176 0.84 CA2 (0.56) CA2AKR1B1PDGFRBPDGFRACA12
SCHEMBL28568569 0.82 CA2 (0.71) CA2AKR1B1FLT3DAODDO
SCHEMBL29520525 0.82 CA2 (0.57) CA2AKR1B1CA12CA1CA9
SCHEMBL13542579 0.80 CA2 (0.51) CA2AKR1B1CA12CA1CA9
SCHEMBL1975132 0.79 CA2 (0.50) CA2AKR1B1DAODDOCA12
SCHEMBL14502491 0.78 CA2 (0.53) CA2AKR1B1CA12CA1CA9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5567827-A 4-Hydroxyphenylthio derivatives, their preparation and their use for the preparation of aminoalkoxyphenylsulphonyl derivatives ELF SANOFI (FR) 1996-10-22 US disclosed
US-5508431-A 4-hydroxyphenylthio derivatives, their preparation and their use for the preparation of aminoalkoxyphenylsulphonyl derivatives ELF SANOFI (FR) 1996-04-16 US disclosed
US-5401855-A 4-hydroxyphenylthio derivatives, their preparation and their use for the preparation of aminoalkoxyphenylsulphonyl derivatives ELF SANOFI (FR) 1995-03-28 US disclosed