SCHEMBL7064468

SCHEMBL7064468

CCCCCNC(=O)C(Cc1ccc(N)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.61
PTPRA P18433 1/20 0.61
CTSS P25774 6/20 0.55
CTSK P43235 5/20 0.55
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
AKT1 P31749 1/20 0.53
PLG P00747 1/20 0.52
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
GRIA1 P42261 1/20 0.49
PTPN22 Q9Y2R2 1/20 0.49

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
SCHEMBL5665787 0.89 CTSS (0.67) PTPN1PTPRACTSSCTSKPLG
SCHEMBL21318569 0.89 CTSS (0.67) PTPN1PTPRACTSSCTSKPLG
SCHEMBL7064457 0.89 CTSK (0.69) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL31628753 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL31628751 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL31628776 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL31628716 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL3174229 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL31628718 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL
SCHEMBL28520727 0.88 PTPN1 (0.68) PTPN1PTPRACTSSCTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313696-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-05-28 EP disclosed
US-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors ABBOTT LABORATORIES 2002-03-21 US disclosed
WO-2002018323-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2002-03-07 WO 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 (1 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-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors PPM1A, PTPRO, PTP4A1 PTPN1 10/4885PTPRA 11/4885CTSS 3898/4885

“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.