SCHEMBL4014830

SCHEMBL4014830

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

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 5/20 0.37
DPP4 P27487 2/20 0.37
DPP8 Q6V1X1 2/20 0.37
DPP9 Q86TI2 2/20 0.37
DPP7 Q9UHL4 2/20 0.37
ALDH1A1 P00352 1/20 0.33
METAP1 P53582 1/20 0.32
FAP Q12884 1/20 0.31
SLC7A5 Q01650 1/20 0.31
ARG1 P05089 2/20 0.30
ARG2 P78540 1/20 0.30
ECE1 P42892 1/20 0.30

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
SCHEMBL4008710 1.00 GPR88 (0.37) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4008993 1.00 GPR88 (0.37) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4009484 0.92 DPP7 (0.44) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4010179 0.92 DPP7 (0.44) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4017601 0.92 DPP7 (0.44) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4014252 0.90 GPR88 (0.39) GPR88DPP4DPP8DPP9ALDH1A1
SCHEMBL4006601 0.90 GPR88 (0.39) GPR88DPP4DPP8DPP9ALDH1A1
SCHEMBL4011755 0.90 GPR88 (0.39) GPR88DPP4DPP8DPP9ALDH1A1
SCHEMBL4015614 0.89 MME (0.36) GPR88DPP4DPP8DPP9DPP7
SCHEMBL4014953 0.89 SLC15A1 (0.36) GPR88DPP8DPP7ALDH1A1METAP1

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 GPR88 767/4885DPP4 1906/4885DPP8 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.