SCHEMBL4012767

SCHEMBL4012767

O=S(=O)(O)Nc1ccc(CC(c2cscn2)c2cccs2)cc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTPRB P23467 20/20 0.43
▸ PTPN11 Q06124 1/20 0.43

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
SCHEMBL876086 0.85 PTPRB (0.45) PTPRB
SCHEMBL19649501 0.80 PTPRB (0.45) PTPRB
SCHEMBL19649500 0.72 PTPRB (0.51) PTPRB
SCHEMBL14635271 0.70 PTPRB (0.74) PTPRB
SCHEMBL14635272 0.70 PTPRB (0.74) PTPRB
SCHEMBL19575794 0.68 PTPRB (0.56) PTPRB
SCHEMBL16573545 0.67 PTPRB (0.64) PTPRBPTPN11
SCHEMBL22627135 0.67 PTPRB (0.64) PTPRBPTPN11
SCHEMBL19649516 0.66 PTPRB (0.68) PTPRB
SCHEMBL21308071 0.65 PTPRB (0.63) PTPRBPTPN11

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
Send feedback