SCHEMBL14167626

SCHEMBL14167626

O=C(O)CCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 4/20 0.43
▸ GART P22102 5/20 0.41
▸ SLC15A2 Q16348 1/20 0.39
▸ SLC6A5 Q9Y345 1/20 0.39
▸ TYMS P04818 2/20 0.38
▸ ATIC P31939 2/20 0.38
▸ FOLH1 Q04609 5/20 0.37
▸ NAALAD2 Q9Y3Q0 1/20 0.37
▸ GNPAT O15228 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
SCHEMBL2150241 0.98 GART (0.42) NOD1GARTSLC15A2SLC6A5TYMS
SCHEMBL14167462 0.97 NOD1 (0.46) NOD1GARTSLC6A5TYMSATIC
SCHEMBL14167513 0.97 NOD1 (0.46) NOD1GARTSLC6A5TYMSATIC
SCHEMBL2157922 0.90 NOD1 (0.39) NOD1GARTSLC15A2SLC6A5TYMS
SCHEMBL19051472 0.89 SLC6A5 (0.39) GARTSLC6A5GNPAT
SCHEMBL31265388 0.87 SLC15A2 (0.44) GARTSLC15A2TYMSATICFOLH1
SCHEMBL29870996 0.87 SLC15A2 (0.44) GARTSLC15A2TYMSATICFOLH1
SCHEMBL7807950 0.86 SLC15A2 (0.49) GARTSLC15A2FOLH1NAALAD2
SCHEMBL30781162 0.86 SLC6A5 (0.37) SLC6A5FOLH1
SCHEMBL19051570 0.85 NAALAD2 (0.39) SLC15A2FOLH1NAALAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029325-B2 Amylin analogues and pharmaceutical compositions thereof NOVO NORDISK A/S (DK) 2015-05-12 — — US disclosed
US-8722849-B2 Polypeptides NOVO NORDISK A/S (DK) 2014-05-13 — — US disclosed
EP-2718314-A2 POLYPEPTIDES Novo Nordisk A/S (DK) 2014-04-16 — — EP disclosed
EP-2718316-A1 POLYPEPTIDES Novo Nordisk A/S (DK) 2014-04-16 — — EP disclosed
EP-2718315-A2 POLYPEPTIDES Novo Nordisk A/S (DK) 2014-04-16 — — EP disclosed
US-20140018286-A1 AMYLIN ANALOGUES AND PHARMACEUTICAL COMPOSITIONS THEREOF NOVO NORDISK A/S (DK) 2014-01-16 — — US disclosed
US-8575090-B2 Amylin analogues and pharmaceutical compositions thereof NOVO NORDISK A/S (DK) 2013-11-05 — — US disclosed
US-20130059770-A1 POLYPEPTIDES NOVO NORDISK A/S (DK) 2013-03-07 — — US disclosed
US-20130005646-A1 POLYPEPTIDES NOVO NORDISK A/S (DK) 2013-01-03 — — US disclosed
WO-2012168430-A2 POLYPEPTIDES NOVO NORDISK A/S (DK) 2012-12-13 — — WO disclosed
WO-2012168432-A1 POLYPEPTIDES NOVO NORDISK A/S (DK) 2012-12-13 — — WO disclosed
WO-2012168431-A2 POLYPEPTIDES NOVO NORDISK A/S (DK) 2012-12-13 — — 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 (3 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-20130005646-A1 POLYPEPTIDES IAPP, GLP1R, GIPR NOD1 3819/4885GART 1699/4885SLC15A2 3036/4885
US-20140018286-A1 AMYLIN ANALOGUES AND PHARMACEUTICAL COMPOSITIONS THEREOF IAPP, GLP1R, GCG NOD1 2245/4885GART 164/4885SLC15A2 2814/4885
US-20130059770-A1 POLYPEPTIDES IAPP, GLP1R, GIPR NOD1 3819/4885GART 1699/4885SLC15A2 3036/4885

“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.

Send feedback