SCHEMBL5840776

SCHEMBL5840776

Cc1ccccc1COC(=O)[C@]1(N)CC[C@H]2[C@H](C(=O)O)[C@H]21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
GRM8 O00222 1/20 0.47
GRM6 O15303 1/20 0.47
GRM2 Q14416 1/20 0.47
GRM3 Q14832 1/20 0.47
ALDH1A1 P00352 3/20 0.37
MAOB P27338 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ADORA2A P29274 1/20 0.37
S1PR1 P21453 1/20 0.36
S1PR5 Q9H228 1/20 0.36
GRIN2B Q13224 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CASP3 P42574 1/20 0.36
CDC37 Q16543 1/20 0.36
LMNA P02545 1/20 0.36
FFAR1 O14842 2/20 0.34
THRA P10827 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
Hydrochloric Acid SCHEMBL5840768 0.99 SLC1A2 (0.47) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL5841166 0.87 SLC1A2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841578 0.86 GRM2 (0.47) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5840168 0.86 SLC1A2 (0.45) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841613 0.85 GRM2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841620 0.85 GRM2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL6465474 0.85 GRM2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841686 0.84 GRM2 (0.45) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841488 0.83 GRM8 (0.43) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL5839843 0.82 SLC1A2 (0.42) SLC1A2SLC1A1GRM8GRM6GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7038077-B2 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY (US) 2006-05-02 US disclosed
US-20050009912-A1 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY 2005-01-13 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-20050009912-A1 Prodrugs of excitatory amino acids SLC1A2, SLC1A3, SLC1A1 SLC1A2 1/4885SLC1A1 3/4885GRM8 46/4885

“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.