SCHEMBL7254530

SCHEMBL7254530

COC(=O)N[C@@H](Cc1ccc(N(C(=O)C(=O)O)c2ccccc2C(=O)O)cc1)C(=O)NCCCCOc1cccc(O)c1C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 20/20 0.78
▸ PTPRA P18433 8/20 0.78
▸ PTPN2 P17706 3/20 0.78
▸ PTPRF P10586 1/20 0.78
▸ PTPN22 Q9Y2R2 2/20 0.57

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
SCHEMBL6504066 0.96 PTPN1 (0.85) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL7117630 0.91 PTPN1 (0.92) PTPN1PTPRAPTPN2PTPRF
SCHEMBL7259511 0.91 PTPN1 (0.83) PTPN1PTPRAPTPN2PTPRF
SCHEMBL7254363 0.90 PTPN1 (0.90) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL7050875 0.90 PTPN1 (0.79) PTPN1PTPRAPTPN2PTPRF
SCHEMBL29384398 0.88 PTPN1 (1.00) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6500588 0.88 PTPN1 (1.00) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL7519706 0.87 PTPN1 (0.74) PTPN1PTPRAPTPN2PTPRF
SCHEMBL6504012 0.87 PTPN1 (0.90) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6500055 0.87 PTPN1 (0.87) PTPN1PTPRAPTPN2PTPRFPTPN22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003072537-A2 SELECTIVE PROTEIN TYROSINE PHOSPHATATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-09-04 — — WO disclosed
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