SCHEMBL3392673

SCHEMBL3392673

CC(C)(C)OC(=O)N1CC2CCC(Oc3ccc(F)cc3C#N)CC2CC1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.39
AR P10275 3/20 0.37
GRIK1 P39086 3/20 0.36
GRIA2 P42262 3/20 0.36
TBK1 Q9UHD2 6/20 0.36
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
PDE9A O76083 1/20 0.35
PDE4B Q07343 1/20 0.35
IKBKE Q14164 1/20 0.34
RBP4 P02753 1/20 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
SCHEMBL3303609 1.00 GPR119 (0.39) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3305319 0.90 GRIK1 (0.41) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3394761 0.90 GRIK1 (0.41) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3395793 0.90 GRIK1 (0.41) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3395739 0.89 GRIK1 (0.37) GPR119ARGRIK1GRIA2
SCHEMBL3393330 0.87 GRIK1 (0.41) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3298914 0.86 AR (0.37) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3393487 0.86 AR (0.37) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3394767 0.85 GRIK1 (0.42) GPR119ARGRIK1GRIA2TBK1
SCHEMBL3395387 0.84 GPR119 (0.37) GPR119ARGRIK1GRIA2PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2166003-A1 Excitatory amino acid receptor antagonists Eli Lilly & Company (US) 2010-03-24 EP disclosed
US-20060100237-A1 Excitatory amino acid receptor antagonists ARNOLD MACKLIN B 2006-05-11 US disclosed
US-20040138254-A1 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY 2004-07-15 US disclosed
EP-1368032-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2003-12-10 EP disclosed
WO-2003024453-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2003-03-27 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 (2 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-20040138254-A1 Excitatory amino acid receptor antagonists SLC1A2, SLC1A1, GRIN1 GPR119 108/4885AR 1391/4885GRIK1 8/4885
US-20060100237-A1 Excitatory amino acid receptor antagonists SLC1A2, SLC1A1, GRIN1 GPR119 108/4885AR 1391/4885GRIK1 8/4885

“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.