SCHEMBL6572483

SCHEMBL6572483

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

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 13/20 0.55
NAALAD2 Q9Y3Q0 2/20 0.51
PTPN1 P18031 1/20 0.48
KLKB1 P03952 1/20 0.47

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
SCHEMBL6572481 1.00 FOLH1 (0.55) FOLH1NAALAD2PTPN1KLKB1
SCHEMBL6572644 0.90 KLKB1 (0.53) FOLH1PTPN1KLKB1
SCHEMBL6572641 0.90 KLKB1 (0.53) FOLH1PTPN1KLKB1
SCHEMBL6573491 0.89 KLKB1 (0.56) PTPN1KLKB1
SCHEMBL6573487 0.89 KLKB1 (0.56) PTPN1KLKB1
SCHEMBL4315645 0.89 KLKB1 (0.56) FOLH1PTPN1KLKB1
SCHEMBL4315647 0.89 KLKB1 (0.56) FOLH1PTPN1KLKB1
SCHEMBL6571743 0.89 KLKB1 (0.56) FOLH1PTPN1KLKB1
SCHEMBL6575626 0.88 PTPN1 (0.58) FOLH1PTPN1
SCHEMBL6571434 0.87 PTPN1 (0.62) PTPN1

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