SCHEMBL6505762

SCHEMBL6505762

COC(=O)N[C@@H](Cc1ccc(N(C(=O)C(=O)O)c2ccccc2C(=O)O)cc1)C(=O)NCCCCOc1cc(-c2ccccc2)cc(O)c1C(=O)OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 20/20 1.00
▸ PTPRA P18433 10/20 0.72
▸ PTPN2 P17706 3/20 0.72
▸ PTPRF P10586 1/20 0.72
▸ PTPN22 Q9Y2R2 1/20 0.53

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
SCHEMBL7117630 0.96 PTPN1 (0.92) PTPN1PTPRAPTPN2PTPRF
SCHEMBL6504012 0.93 PTPN1 (0.90) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6500055 0.93 PTPN1 (0.87) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6493896 0.93 PTPN1 (0.86) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6504066 0.91 PTPN1 (0.85) PTPN1PTPRAPTPN2PTPRFPTPN22
SCHEMBL6503579 0.90 PTPN1 (0.82) PTPN1PTPRAPTPN2PTPRF
SCHEMBL7259511 0.89 PTPN1 (0.83) PTPN1PTPRAPTPN2PTPRF
SCHEMBL7050875 0.88 PTPN1 (0.79) PTPN1PTPRAPTPN2PTPRF
SCHEMBL6491517 0.88 PTPN1 (0.78) PTPN1PTPRAPTPN2PTPRF
SCHEMBL7254530 0.87 PTPN1 (0.78) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6972340-B2 Selective protein tyrosine phosphatatase inhibitors ABBOTT LABORATORIES (US) 2005-12-06 — — US claimed
WO-2003020688-A1 SELECTIVE PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-03-13 — — WO claimed
US-20020169157-A1 Selective protein tyrosine phosphatatase inhibitors ABBOTT LABORATORIES 2002-11-14 — — US claimed
US-20020072516-A1 Selective protein tyrosine phosphatatase inhibitors ABBVIE INC. 2002-06-13 — — US claimed
US-6972340-B2 Selective protein tyrosine phosphatatase inhibitors ABBOTT LABORATORIES (US) 2005-12-06 — — US disclosed
US-20020169157-A1 Selective protein tyrosine phosphatatase inhibitors ABBOTT LABORATORIES 2002-11-14 — — US disclosed
US-20020072516-A1 Selective protein tyrosine phosphatatase inhibitors ABBVIE INC. 2002-06-13 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020169157-A1 Selective protein tyrosine phosphatatase inhibitors PPM1B, PPM1A, PPM1D PTPN1 10/4885PTPRA 59/4885PTPN2 41/4885
US-20020072516-A1 Selective protein tyrosine phosphatatase inhibitors PPM1B, PPM1A, PPM1D PTPN1 10/4885PTPRA 59/4885PTPN2 41/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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