SCHEMBL4012004

SCHEMBL4012004

CCCCC(C)CC(CC(=O)O)NC(=O)CN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 4/20 0.47
PLA2G2C Q5R387 1/20 0.42
DNM1 Q05193 1/20 0.39
CACNA2D1 P54289 2/20 0.37
CACNB3 P54284 1/20 0.37
CACNA1C Q13936 1/20 0.37
PGR P06401 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR2B P41595 1/20 0.37
CACNA2D2 Q9NY47 1/20 0.37
CTSC P53634 1/20 0.36
GPR84 Q9NQS5 4/20 0.36
ACE2 Q9BYF1 1/20 0.35
PDF Q9HBH1 1/20 0.35
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
ITGB3 P05106 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
SCHEMBL4014191 1.00 PLA2G10 (0.47) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4009814 1.00 PLA2G10 (0.47) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4005328 0.91 PLA2G10 (0.43) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4008884 0.91 PLA2G10 (0.43) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4015335 0.91 PLA2G10 (0.43) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4015196 0.87 PLA2G10 (0.44) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4009514 0.87 PLA2G10 (0.46) PLA2G10PLA2G2CDNM1GPR84ACE2
SCHEMBL4008875 0.86 PLA2G10 (0.45) PLA2G10PLA2G2CDNM1CACNA2D1CACNB3
SCHEMBL4007726 0.84 PLA2G10 (0.42) PLA2G10DNM1CACNA2D1CACNB3CACNA1C
SCHEMBL4007883 0.84 PLA2G10 (0.42) PLA2G10DNM1CACNA2D1CACNB3CACNA1C

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 PLA2G10 2762/4885PLA2G2C 1607/4885DNM1 1445/4885

“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.