SCHEMBL5837778

SCHEMBL5837778

NC(Cc1ccccc1)C(=O)NCC1OCCc2c1sc(NC(=O)C(=O)O)c2C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 19/20 0.52
PTPN2 P17706 10/20 0.52
PTPRB P23467 3/20 0.52
PTPRC P08575 2/20 0.40
PTPRE P23469 2/20 0.40
PTPRA P18433 2/20 0.38
PTPN6 P29350 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
SCHEMBL5837791 1.00 PTPN1 (0.52) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL7539431 0.85 PTPN2 (0.39) PTPN1PTPN2PTPRB
SCHEMBL5842687 0.83 PTPN1 (0.51) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL6205716 0.82 PTPN1 (0.51) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL5842479 0.79 PTPN1 (0.45) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL5838315 0.78 PTPN1 (0.48) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL5837036 0.76 PTPN1 (0.55) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL6208795 0.74 PTPN1 (0.59) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL5838411 0.71 PTPN1 (0.57) PTPN1PTPN2PTPRBPTPRCPTPRE
SCHEMBL7119946 0.68 PTPN1 (0.42) PTPN1PTPN2PTPRBPTPRCPTPRE

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 6 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
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 claimed
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 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
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-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