SCHEMBL23699449

SCHEMBL23699449

N[C@@]1(C(=O)O)[C@H](OCc2ccc(F)c(F)c2)CC2[C@H](C(=O)O)[C@H]21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 1.00
GRM3 Q14832 10/20 1.00
GRM8 O00222 2/20 0.46
GRM6 O15303 2/20 0.46

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
SCHEMBL20730930 1.00 GRM2 (1.00) GRM2GRM3GRM8GRM6
SCHEMBL20722216 1.00 GRM2 (1.00) GRM2GRM3GRM8GRM6
SCHEMBL22130893 0.89 GRM2 (0.80) GRM2GRM3
SCHEMBL19508605 0.87 GRM2 (0.78) GRM2GRM3
SCHEMBL19508606 0.87 GRM2 (0.78) GRM2GRM3
SCHEMBL22130892 0.85 GRM2 (0.74) GRM2GRM3GRM8GRM6
SCHEMBL20309304 0.84 GRM2 (0.73) GRM2GRM3GRM8GRM6
SCHEMBL233370 0.84 GRM2 (0.73) GRM2GRM3GRM8GRM6
SCHEMBL7392651 0.83 GRM2 (0.71) GRM2GRM3GRM8
SCHEMBL8764439 0.81 GRM2 (0.81) GRM2GRM3GRM8GRM6

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
EP-3445743-B1 PRODRUG OF AMINO ACID DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2021-08-04 EP disclosed