SCHEMBL4052474

SCHEMBL4052474

COC(=O)Cc1ccc(N=C2SC(=Cc3ccc(OCc4ccc(F)cc4)cc3)C(=O)N2C)cc1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DUSP26 Q9BV47 3/20 0.69
PTPN1 P18031 9/20 0.64
MGAM O43451 2/20 0.54
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
PTPN7 P35236 1/20 0.54
DUSP3 P51452 1/20 0.54
PTPN12 Q05209 1/20 0.54
PTPN22 Q9Y2R2 1/20 0.54
ACP1 P24666 4/20 0.53
PTPN2 P17706 2/20 0.53
ENPP2 Q13822 1/20 0.49
AURKA O14965 1/20 0.48

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
SCHEMBL4052471 1.00 DUSP26 (0.69) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4048414 0.91 PTPN1 (0.75) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4057079 0.83 PTPN1 (0.76) DUSP26PTPN1PTPN7DUSP3PTPN12
SCHEMBL4057081 0.83 PTPN1 (0.76) DUSP26PTPN1PTPN7DUSP3PTPN12
SCHEMBL4056648 0.81 PTPN1 (0.71) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4056644 0.81 PTPN1 (0.71) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4225045 0.81 PTPN1 (0.73) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4049524 0.81 PTPN1 (0.73) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4060687 0.81 PTPN1 (0.73) DUSP26PTPN1MGAMCA12CA1
SCHEMBL4225044 0.81 PTPN1 (0.73) DUSP26PTPN1MGAMCA12CA1

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
WO-2009109998-A1 NOVEL PROTEIN TYROSINE PHOSPHATASE - IB INHIBITORS LUPIN LIMITED (IN) 2009-09-11 WO disclosed