SCHEMBL6575436

SCHEMBL6575436

CCCCCNC(=O)[C@H](Cc1ccc(OC(C(=O)O)C(=O)O)cc1)NC(=O)[C@H](Cc1ccc(C(=O)c2ccccc2)cc1)NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.51
PTPRA P18433 3/20 0.51
KLKB1 P03952 1/20 0.49
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
SRC P12931 1/20 0.47
PTPN22 Q9Y2R2 1/20 0.46
PTPN2 P17706 1/20 0.46
PLG P00747 3/20 0.46
PRSS1 P07477 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46

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
SCHEMBL6573397 0.90 PTPN1 (0.59) PTPN1KLKB1
SCHEMBL6574928 0.90 PTPN1 (0.59) PTPN1KLKB1
SCHEMBL6575040 0.89 PTPN1 (0.65) PTPN1PTPRAPTPN22
SCHEMBL6571661 0.87 PTPN1 (0.56) PTPN1
SCHEMBL4650398 0.84 L3MBTL1 (0.66) PTPN1KLKB1PTPN22PLGPRSS1
SCHEMBL4315645 0.83 KLKB1 (0.56) PTPN1KLKB1KMT2APTPN22PLG
SCHEMBL6571743 0.83 KLKB1 (0.56) PTPN1KLKB1KMT2APTPN22PLG
SCHEMBL4315647 0.83 KLKB1 (0.56) PTPN1KLKB1KMT2APTPN22PLG
SCHEMBL6572379 0.83 PTPN1 (0.54) PTPN1PTPRAKLKB1PTPN22PTPN2
SCHEMBL6574908 0.83 PTPN1 (0.66) PTPN1KLKB1PLGPRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6353023-B1 AROMATIC COMPOUNDS WITH AMIDE GROUPS PHARMACIA & UPJOHN COMPANY 2002-03-05 US claimed
EP-1019364-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 2000-07-19 EP claimed
WO-1999011606-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 1999-03-11 WO claimed
EP-1019364-B1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE BIOVITRUM AB (SE) 2004-06-09 EP disclosed
US-6410585-B1 THERAPY FOR NON-INSULIN DEPEND DIABETES BIOVITRUM AB (SE) 2002-06-25 US disclosed
US-6353023-B1 AROMATIC COMPOUNDS WITH AMIDE GROUPS PHARMACIA & UPJOHN COMPANY 2002-03-05 US disclosed
EP-1019364-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 2000-07-19 EP disclosed
WO-1999011606-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PHARMACIA & UPJOHN COMPANY (US) 1999-03-11 WO disclosed