SCHEMBL1768439

SCHEMBL1768439

CNCC(=O)NC[C@H](N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GFPT1 Q06210 1/20 0.46
SLC7A5 Q01650 1/20 0.39
PMP22 Q01453 1/20 0.37
CASR P41180 2/20 0.37
PTGS1 P23219 1/20 0.37
SLC7A11 Q9UPY5 1/20 0.37
GGT1 P19440 2/20 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
SCHEMBL1768440 1.00 GFPT1 (0.46) GFPT1SLC7A5PMP22CASRPTGS1
SCHEMBL1768767 0.81 OTC (0.46) PMP22GGT1
SCHEMBL1768764 0.81 OTC (0.46) PMP22GGT1
SCHEMBL1768761 0.81 GFPT1 (0.44) GFPT1SLC7A5PMP22CASR
SCHEMBL1768765 0.81 GFPT1 (0.44) GFPT1SLC7A5PMP22CASR
SCHEMBL1768908 0.79 GFPT1 (0.49) GFPT1SLC7A5PMP22CASRPTGS1
SCHEMBL1768905 0.79 GFPT1 (0.49) GFPT1SLC7A5PMP22CASRPTGS1
SCHEMBL13585097 0.78 GFPT1 (0.45) GFPT1SLC7A5PMP22CASR
SCHEMBL13585101 0.78 GFPT1 (0.45) GFPT1SLC7A5PMP22CASR
SCHEMBL17852316 0.78 GFPT1 (0.41) GFPT1CASRPTGS1SLC7A11GGT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754038-B2 Template-fixed peptidomimetics with CCR10 antagonistic activity POLYPHOR AG (CH) 2014-06-17 US disclosed
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2012-11-08 US disclosed
EP-2501715-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY Polyphor Ag (CH) 2012-09-26 EP disclosed
WO-2011060937-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY POLYPHOR AG (CH) 2011-05-26 WO disclosed
WO-2011060832-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2011-05-26 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-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY CCR10, CCR1, CCRL2 GFPT1 3069/4885SLC7A5 1767/4885PMP22 1622/4885

“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.