SCHEMBL5771293

SCHEMBL5771293

O=C(O)C(=O)Nc1sc2c(c1C(=O)O)CCN[C@H]2CNC(=O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.60
OPRM1 P35372 10/20 0.41
OPRK1 P41145 8/20 0.41
OPRD1 P41143 4/20 0.41
PTPN2 P17706 4/20 0.41
PTPRC P08575 2/20 0.41
PTPRB P23467 1/20 0.36
PTPRE P23469 1/20 0.36
PTPN6 P29350 1/20 0.36

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
SCHEMBL5771521 0.94 PTPN1 (0.61) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL5770525 0.90 PTPN1 (0.65) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL5769077 0.86 PTPN1 (0.59) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL5769105 0.86 PTPN1 (0.59) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL5769028 0.85 PTPN1 (0.58) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL5770158 0.84 PTPN1 (0.63) PTPN1OPRM1OPRK1OPRD1PTPN2
SCHEMBL14586375 0.82 PTPN1 (0.73) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5769138 0.81 PTPN1 (0.84) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5770879 0.81 PTPN1 (0.84) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL5769588 0.81 PTPN1 (0.59) PTPN1OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301516-B1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK AS (DK) 2006-03-22 EP disclosed
US-6613903-B2 Such as 7-(benzoylamino-methyl)-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thieno(2,3 -c)pyridine-3-carboxylic acid for treatment of diabetes, insulin resistance, and obesity NOVO NORDISK A/S (DK) 2003-09-02 US disclosed
EP-1301516-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2003-04-16 EP disclosed
US-20020151561-A1 Modulators of Protein Tyrosine Phosphatases (PTPases) NOVO NORDISK A/S (DK) 2002-10-17 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 (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-20020151561-A1 Modulators of Protein Tyrosine Phosphatases (PTPases) PTPRO, PTPN1, PTPRS PTPN1 2/4885OPRM1 3691/4885OPRK1 3851/4885

“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.