SCHEMBL4964971

SCHEMBL4964971

N[C@]1(C(=O)O)[C@H]2[C@@H](C[C@H]1OC1CCCC1)[C@]2(F)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 1.00
GRM3 Q14832 3/20 1.00

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
SCHEMBL20731384 1.00 GRM2 (1.00) GRM2GRM3
SCHEMBL20722244 1.00 GRM2 (1.00) GRM2GRM3
SCHEMBL22130855 0.84 GRM2 (0.73) GRM2GRM3
SCHEMBL22130854 0.82 GRM2 (0.70) GRM2GRM3
SCHEMBL4968500 0.79 GRM2 (0.65) GRM2GRM3
SCHEMBL20722249 0.78 GRM2 (0.62) GRM2GRM3
SCHEMBL23718799 0.73 GRM2 (0.74) GRM2GRM3
SCHEMBL4967945 0.73 GRM2 (0.63) GRM2GRM3
SCHEMBL4964629 0.73 GRM2 (0.74) GRM2GRM3
SCHEMBL16713408 0.72 GRM2 (0.55) GRM2GRM3

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
US-10689327-B2 Prodrug amino acid derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2020-06-23 US disclosed
US-20190337887-A1 PRODRUG OF AMINO ACID DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2019-11-07 US disclosed
EP-1459765-B1 6-FLUOROBICYCLO 3.1.0 HEXANE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2008-08-20 EP disclosed
US-7157594-B2 6-Fluorobicyclo[3.1.0]hexane derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-01-02 US disclosed
US-20050119345-A1 6-Fluorobicyclo[3.1.0]hexane derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2005-06-02 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 (3 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-10689327-B2 Prodrug amino acid derivative GRIN2A, SLC1A2, SLC1A1 GRM2 12/4885GRM3 26/4885
US-20190337887-A1 PRODRUG OF AMINO ACID DERIVATIVE GRIN2A, SLC1A2, SLC1A1 GRM2 13/4885GRM3 28/4885
US-20050119345-A1 6-Fluorobicyclo[3.1.0]hexane derivatives GRM1, GRM2, GRM6 GRM2 2/4885GRM3 4/4885

“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.