SCHEMBL4014281

SCHEMBL4014281

CCCCC(C)CC(CNC(=O)[C@H](C)N)CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 1/20 0.44
DPP7 Q9UHL4 4/20 0.41
DPP8 Q6V1X1 2/20 0.41
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
CACNA2D1 P54289 2/20 0.35
CACNB3 P54284 1/20 0.35
CACNA1C Q13936 1/20 0.35
PGR P06401 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
CACNA2D2 Q9NY47 1/20 0.35
GPR84 Q9NQS5 4/20 0.34
DPP4 P27487 1/20 0.34
DPP9 Q86TI2 1/20 0.34
GPR88 Q9GZN0 2/20 0.34
ACE2 Q9BYF1 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL4011517 1.00 SLC15A1 (0.44) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4007904 1.00 SLC15A1 (0.44) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4009947 0.92 GPR88 (0.39) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4014266 0.92 GPR88 (0.39) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4008280 0.92 GPR88 (0.39) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4008015 0.89 DPP7 (0.44) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4008978 0.89 DPP7 (0.44) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4009524 0.89 DPP7 (0.44) SLC15A1DPP7DPP8SLC1A3SLC1A2
SCHEMBL4010152 0.88 DPP7 (0.41) SLC15A1DPP7SLC1A3SLC1A2SLC1A1
SCHEMBL4005354 0.88 DPP7 (0.41) SLC15A1DPP7SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491835-B2 Prodrugs of amino acids with affinity for the α2δ-protein PFIZER INC (US) 2009-02-17 US claimed
EP-1670750-A1 PRODRUGS OF AMINO ACIDS WITH AFFINITY FOR THE ALPHA2DELTA- PROTEIN Warner-Lambert Company LLC (US) 2006-06-21 EP claimed
WO-2005030703-A1 PRODRUGS OF AMINO ACIDS WITH AFFINITY FOR THE α2δ- PROTEIN WARNER-LAMBERT COMPANY LLC (US) 2005-04-07 WO claimed
US-20050070483-A1 Prodrugs of amino acids with affinity for the alpha2delta-protein VIATRIS SPECIALTY LLC. 2005-03-31 US claimed
US-7491835-B2 Prodrugs of amino acids with affinity for the α2δ-protein PFIZER INC (US) 2009-02-17 US disclosed
US-20050070483-A1 Prodrugs of amino acids with affinity for the alpha2delta-protein VIATRIS SPECIALTY LLC. 2005-03-31 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-20050070483-A1 Prodrugs of amino acids with affinity for the alpha2delta-protein SCN2A, OPRD1, SCN1A SLC15A1 745/4885DPP7 1105/4885DPP8 2187/4885

“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.