SCHEMBL13613758

SCHEMBL13613758

C=CCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N(CCC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)CC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.41
GRB2 P62993 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
SCHEMBL15341075 0.78 PTPN1 (0.43) PTPN1
SCHEMBL9910847 0.77 MDM2 (0.35) PTPN1
SCHEMBL4356052 0.76 CTSS (0.39) PTPN1
SCHEMBL4356049 0.76 CTSS (0.39) PTPN1
SCHEMBL13613757 0.75 CTSK (0.47)
SCHEMBL30887576 0.75 PTPN1 (0.51) PTPN1
Hydrochloric Acid SCHEMBL30261435 0.74 PTPN1 (0.50) PTPN1
SCHEMBL30065504 0.74 PTPN1 (0.53) PTPN1GRB2
SCHEMBL30065443 0.74 PTPN1 (0.49) PTPN1GRB2
SCHEMBL29978024 0.73 PTPN1 (0.54) PTPN1GRB2

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-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 US disclosed
US-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 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-20090275727-A1 Peptide turn mimetics IAPP, GLP1R, VIP PTPN1 2158/4885GRB2 3658/4885

“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.