SCHEMBL3936244

SCHEMBL3936244

COC(=O)C(Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1csc(-c2sccc2C)n1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 20/20 0.79
PTPN1 P18031 1/20 0.51

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
SCHEMBL3616748 1.00 PTPRB (0.79) PTPRBPTPN1
SCHEMBL3616753 1.00 PTPRB (0.79) PTPRBPTPN1
SCHEMBL3928276 1.00 PTPRB (0.79) PTPRBPTPN1
SCHEMBL3610661 0.92 PTPRB (0.80) PTPRBPTPN1
SCHEMBL3610658 0.92 PTPRB (0.80) PTPRBPTPN1
SCHEMBL3616614 0.89 PTPRB (0.78) PTPRBPTPN1
SCHEMBL3616620 0.89 PTPRB (0.78) PTPRBPTPN1
SCHEMBL29498191 0.89 PTPRB (0.64) PTPRBPTPN1
SCHEMBL679580 0.88 PTPRB (1.00) PTPRB
SCHEMBL468247 0.88 PTPRB (1.00) PTPRB

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-2041102-A2 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE The Procter & Gamble Company (US) 2009-04-01 EP disclosed
WO-2008002569-A2 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO disclosed