SCHEMBL27601784

SCHEMBL27601784

O=S(=O)(O)n1c(O)c(O)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.44
FABP4 P15090 2/20 0.44
FABP5 Q01469 2/20 0.44
FABP2 P12104 1/20 0.40
HTR6 P50406 1/20 0.39
POLB P06746 2/20 0.38
PADI4 Q9UM07 1/20 0.38
MAPT P10636 1/20 0.38
AGTR1 P30556 2/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LDHA P00338 1/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL28018005 0.81 FABP4 (0.50) FABP3FABP4FABP5FABP2HTR6
Dimethylformamide SCHEMBL27851067 0.69 POLB (0.43) FABP3FABP4FABP5FABP2HTR6
SCHEMBL6392957 0.69 PARP1 (0.41) FABP3FABP4FABP5HTR6KMT2A
SCHEMBL31623977 0.69 KDM4E (0.39) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL1490129 0.69 KDM4E (0.39) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL6391657 0.68 ERCC1 (0.41) FABP3FABP4FABP5FABP2POLB
SCHEMBL17687427 0.67 HTR6 (0.41) FABP3FABP4FABP5FABP2HTR6
SCHEMBL3564084 0.67 SRC (0.51) FABP3FABP4FABP5HTR6AGTR1
SCHEMBL8822466 0.67 GPR3 (0.58) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL17825377 0.66 MEN1 (0.37) FABP3FABP4FABP5HTR6POLB

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
CN-1662206-A Use of thio-2-oxindole derivatives in treatment of skin disorders WYETH CORP (US) 2005-08-31 CN disclosed