SCHEMBL5837779

SCHEMBL5837779

O=C(O)C(=O)Nc1sc2c(c1C(=O)O)CC(CN1C(=O)c3c(Cl)c(Cl)c(Cl)c(Cl)c3C1=O)OC2

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 17/20 0.45
PTPN2 P17706 6/20 0.45
PTPRC P08575 3/20 0.45
PTPRB P23467 2/20 0.45
PTPRE P23469 2/20 0.45
PTPN6 P29350 1/20 0.43
PTPRA P18433 2/20 0.41
RAB7A P51149 2/20 0.38

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
SCHEMBL6205883 0.87 PTPN1 (0.43) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5837624 0.86 PTPN1 (0.44) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6314433 0.85 PTPN1 (0.46) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6205017 0.85 PTPN1 (0.52) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6207147 0.85 PTPN1 (0.51) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5838269 0.84 PTPN1 (0.44) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5837429 0.83 PTPN1 (0.45) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL7567316 0.83 RAB7A (0.33) PTPN1RAB7A
SCHEMBL6321876 0.82 PTPN1 (0.47) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5838650 0.82 PTPN1 (0.44) PTPN1PTPN2PTPRCPTPRBPTPRE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115624-B1 Method of inhibiting protein tyrosine phosphatase 1B and/or T-cell protein tyrosine phosphatase 4 and/or other PTPases with an Asp residue at position 48 NOVO NORDISK A/S (DK) 2006-10-03 US claimed
US-7019026-B1 Modulators of Protein Tyrosine Phosphatases (PTPases) NOVO NORDISK A/S (DK) 2006-03-28 US claimed
EP-1214325-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2002-06-19 EP claimed
WO-2001019831-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO claimed
US-7115624-B1 Method of inhibiting protein tyrosine phosphatase 1B and/or T-cell protein tyrosine phosphatase 4 and/or other PTPases with an Asp residue at position 48 NOVO NORDISK A/S (DK) 2006-10-03 US disclosed
US-7019026-B1 Modulators of Protein Tyrosine Phosphatases (PTPases) NOVO NORDISK A/S (DK) 2006-03-28 US disclosed
EP-1214325-B1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK AS (DK) 2005-11-09 EP disclosed
EP-1214325-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2002-06-19 EP disclosed
EP-1214060-A2 METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK A/S (DK) 2002-06-19 EP disclosed
WO-2001019831-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO disclosed
WO-2001017516-A2 METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK A/S (DK) 2001-03-15 WO disclosed