SCHEMBL3263151

SCHEMBL3263151

COC(=O)N(c1ccc2c(c1)sc1c(OCC(=O)O)c(C(=O)O)sc12)C1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.50
PTPN2 P17706 2/20 0.50
PTPRC P08575 1/20 0.37
OPRM1 P35372 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
ENPP2 Q13822 1/20 0.34
DYRK1A Q13627 1/20 0.33

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
SCHEMBL3188864 0.89 PTPN1 (0.48) PTPN1PTPN2PTPRC
SCHEMBL3200174 0.86 PTPN1 (0.54) PTPN1PTPN2PTPRCPTGDR2
SCHEMBL3191956 0.85 F9 (0.33) PTPN1PTPN2OPRM1
SCHEMBL3200852 0.81 PTPN1 (0.54) PTPN1PTPN2PTPRCPTGDR2
SCHEMBL3203630 0.81 PTPN1 (0.48) PTPN1PTPN2PTPRCPTGDR2
SCHEMBL3180825 0.80 PTPN1 (0.52) PTPN1PTPN2PTPRC
SCHEMBL4121435 0.79 PTPN1 (0.44) PTPN1PTPN2PTPRCOPRM1
SCHEMBL3203472 0.77 PTPN1 (0.58) PTPN1PTPN2PTPRC
SCHEMBL3187462 0.76 PTPN2 (0.36) PTPN1PTPN2
SCHEMBL3263156 0.76 PTPN1 (0.39) PTPN1PTPN2PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7674822-B2 protein tyrosine phosphatase 1B (PTP1B) modulators; type 2 diabetes, obesity; increasing insulin sensitivity; 1-Carboxymethoxy-3,8-dithia-cyclopenta[a]indene-2-carboxylic acid WYETH (US) 2010-03-09 US disclosed
US-20060135488-A1 protein tyrosine phosphatase 1B (PTP1B) modulators; type 2 diabetes, obesity; increasing insulin sensitivity; 1-Carboxymethoxy-3,8-dithia-cyclopenta[a]indene-2-carboxylic acid WYETH 2006-06-22 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-20060135488-A1 protein tyrosine phosphatase 1B (PTP1B) modulators; type 2 diabetes, obesity; increasing insulin sensitivity; 1-Carboxymethoxy-3,8-dithia-cyclopenta[a]indene-2-carboxylic acid PTPA, PTPRCAP, PTPRC PTPN1 22/4885PTPN2 14/4885PTPRC 3/4885

“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.