SCHEMBL4007723

SCHEMBL4007723

CCC(C)CCC(NC(=O)CN)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 7/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.39
▸ GNPAT O15228 1/20 0.38
▸ SLC15A2 Q16348 1/20 0.36
▸ FOLH1 Q04609 5/20 0.36
▸ NAALAD2 Q9Y3Q0 3/20 0.35
▸ RIMKLA Q8IXN7 1/20 0.35
▸ MME P08473 1/20 0.35
▸ GABRR1 P24046 2/20 0.34

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
SCHEMBL5698087 0.88 NOD1 (0.43) NOD1SLC6A5GNPATSLC15A2MME
SCHEMBL4008880 0.88 NOD1 (0.43) NOD1SLC6A5GNPATSLC15A2MME
SCHEMBL5698138 0.85 NOD1 (0.48) NOD1SLC6A5GNPAT
SCHEMBL4009812 0.85 NOD1 (0.48) NOD1SLC6A5GNPAT
SCHEMBL19586694 0.84 FOLH1 (0.42) NOD1SLC6A5GNPATSLC15A2FOLH1
SCHEMBL19586695 0.84 FOLH1 (0.42) NOD1SLC6A5GNPATSLC15A2FOLH1
SCHEMBL7175773 0.82 NOD1 (0.49) NOD1SLC6A5GNPATSLC15A2FOLH1
SCHEMBL7175771 0.82 NOD1 (0.49) NOD1SLC6A5GNPATSLC15A2FOLH1
SCHEMBL1133639 0.81 POLB (0.40) NOD1SLC6A5GNPATFOLH1NAALAD2
SCHEMBL8468722 0.81 POLB (0.40) NOD1SLC6A5GNPATFOLH1NAALAD2

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 8 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
EP-1670750-A1 PRODRUGS OF AMINO ACIDS WITH AFFINITY FOR THE ALPHA2DELTA- PROTEIN Warner-Lambert Company LLC (US) 2006-06-21 — — EP disclosed
WO-2005030703-A1 PRODRUGS OF AMINO ACIDS WITH AFFINITY FOR THE α2δ- PROTEIN WARNER-LAMBERT COMPANY LLC (US) 2005-04-07 — — WO 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 NOD1 3810/4885SLC6A5 826/4885GNPAT 1195/4885

“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.

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