SCHEMBL3301475

SCHEMBL3301475

CCC1[C@@H]2CC[C@H](Oc3ccc(Cl)cc3C#N)C[C@@H]2C[C@@H](C(=O)O)N1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.36
PROKR1 Q8TCW9 2/20 0.36
SCN9A Q15858 1/20 0.35
GRIK1 P39086 4/20 0.35
GRIA2 P42262 2/20 0.35
TBK1 Q9UHD2 4/20 0.34
RBP4 P02753 1/20 0.34
GPR119 Q8TDV5 2/20 0.34
EPHX2 P34913 1/20 0.33
IKBKE Q14164 1/20 0.33
RORC P51449 2/20 0.33
CNR2 P34972 1/20 0.32

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
SCHEMBL3303849 0.89 GPR119 (0.35) TBK1GPR119EPHX2
SCHEMBL3303406 0.88 GRIK1 (0.35) GRIK1GRIA2TBK1GPR119
SCHEMBL3306973 0.87 GRIK1 (0.36) GRIK1GRIA2TBK1GPR119IKBKE
SCHEMBL3300496 0.86 GRIK1 (0.40) GRIK1GRIA2RBP4CNR2
SCHEMBL3305704 0.84 GRIK1 (0.40) GRIK1GRIA2RBP4CNR2
SCHEMBL3395793 0.81 GRIK1 (0.41) FPR2PROKR1SCN9AGRIK1GRIA2
SCHEMBL3300235 0.77 GRIK1 (0.34) GRIK1GRIA2GPR119
SCHEMBL3309302 0.76 MEN1 (0.38) GPR119
SCHEMBL3297263 0.76 MEN1 (0.34) SCN9AGRIK1GRIA2GPR119
SCHEMBL3303205 0.75 SMN1; SMN2 (0.35) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100094014-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS MARTINEZ-PEREZ JOSE ANTONIO 2010-04-15 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-20100094014-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS SLC1A2, SLC1A1, GRIN1 FPR2 272/4885PROKR1 543/4885SCN9A 277/4885

“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.