SCHEMBL5502973

SCHEMBL5502973

Cc1ccc(S(=O)(=O)OC(C)CF)cc1.Cc1ccc(S(=O)(=O)OS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
G6PD P11413 2/20 0.38
GBA1 P04062 1/20 0.37
BCHE P06276 2/20 0.37
ACHE P22303 2/20 0.37
ALDH1A1 P00352 5/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
AGER Q15109 1/20 0.37
CA2 P00918 4/20 0.36
CA9 Q16790 3/20 0.36
CA12 O43570 2/20 0.36
VDR P11473 1/20 0.36
TSHR P16473 1/20 0.36
CA1 P00915 3/20 0.36
CA7 P43166 2/20 0.36
CA3 P07451 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
SCHEMBL4121027 0.95 GAA (0.42) GAAG6PDGBA1BCHEACHE
SCHEMBL5831287 0.81 GAA (0.45) GAAG6PDGBA1ALDH1A1CYP3A4
SCHEMBL18737643 0.81 GAA (0.45) GAAG6PDGBA1ALDH1A1CYP3A4
SCHEMBL14778372 0.81 GAA (0.45) GAAG6PDGBA1ALDH1A1CYP3A4
SCHEMBL10932836 0.81 GBA1 (0.46) GAAGBA1ALDH1A1CYP3A4CYP2C9
SCHEMBL17404667 0.81 GAA (0.45) GAAG6PDGBA1ALDH1A1CYP3A4
SCHEMBL5245093 0.81 GBA1 (0.46) GAAGBA1ALDH1A1CYP3A4CYP2C9
SCHEMBL16424498 0.81 GAA (0.45) GAAG6PDGBA1ALDH1A1CYP3A4
SCHEMBL5830519 0.81 GBA1 (0.46) GAAGBA1ALDH1A1CYP3A4CYP2C9
SCHEMBL4130938 0.80 PSIP1 (0.41) ALDH1A1CYP2C9CYP2C19KMT2ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1781643-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
EP-1781642-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006016220-A1 OXINDOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed
WO-2006016221-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed