SCHEMBL3905231

SCHEMBL3905231

N#Cc1ccc(S(=O)(=O)Nc2cccc(-c3sc(C(=O)O)c(OCC(=O)O)c3Cl)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.64
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
ATIC P31939 1/20 0.46

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
SCHEMBL3910461 0.90 PTPN1 (0.68) PTPN1
SCHEMBL3903910 0.90 PTPN1 (0.64) PTPN1HSD17B1HSD17B2ATIC
SCHEMBL3906373 0.90 PTPN1 (0.79) PTPN1
SCHEMBL3910355 0.89 PTPN1 (0.80) PTPN1
SCHEMBL3906788 0.88 PTPN1 (0.66) PTPN1
SCHEMBL3909211 0.86 PTPN1 (0.66) PTPN1
SCHEMBL3911631 0.85 PTPN1 (0.54) PTPN1HSD17B1HSD17B2
SCHEMBL3905896 0.85 PTPN1 (0.64) PTPN1
SCHEMBL3918020 0.82 PTPN1 (0.61) PTPN1
SCHEMBL3906913 0.82 PTPN1 (0.58) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521473-B2 Inhibitors of protein tyrosine phosphatase 1B WYETH (US) 2009-04-21 US disclosed
US-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B WYETH 2005-09-15 US disclosed
WO-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 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-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B PTPRO, PTPRS, PTPRM PTPN1 11/4885HSD17B1 1163/4885HSD17B2 1734/4885

“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.