SCHEMBL6573607

SCHEMBL6573607

CCCCCNC(=O)C(Cc1ccc(OC(C(=O)O)C(=O)O)cc1)C(=O)NCCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.42
PPARA Q07869 1/20 0.42
S1PR1 P21453 1/20 0.41
MMP8 P22894 1/20 0.41
PTPN22 Q9Y2R2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41

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
SCHEMBL6572641 0.86 KLKB1 (0.53) PTPN1PTPN22
SCHEMBL6572644 0.86 KLKB1 (0.53) PTPN1PTPN22
SCHEMBL6571434 0.83 PTPN1 (0.62) PTPN1
SCHEMBL6572344 0.83 PTPN1 (0.62) PTPN1
SCHEMBL6571438 0.83 PTPN1 (0.62) PTPN1
SCHEMBL6575066 0.82 PTPN1 (0.61) PTPN1
SCHEMBL6572533 0.82 PTPN1 (0.56) PTPN1
SCHEMBL6571396 0.82 PTPN1 (0.61) PTPN1
SCHEMBL6571404 0.82 PTPN1 (0.61) PTPN1
SCHEMBL6572536 0.82 PTPN1 (0.56) 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 6 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