SCHEMBL5021687

SCHEMBL5021687

O=C1N[C@H](c2cc(-c3cncc(F)c3)ncc2F)[C@@H](c2ccc(F)cc2)O1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 20/20 0.55
PGR P06401 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL5021869 0.83 GRM5 (0.57) GRM5PGRKCNH2
SCHEMBL5021968 0.81 GRM5 (0.73) GRM5PGRKCNH2
SCHEMBL5021969 0.81 GRM5 (0.73) GRM5PGRKCNH2
SCHEMBL4540474 0.80 GRM5 (0.50) GRM5PGRKCNH2
SCHEMBL4537625 0.80 GRM5 (0.71) GRM5PGRKCNH2
SCHEMBL16364183 0.76 GRM5 (0.67) GRM5PGRKCNH2
SCHEMBL16363933 0.76 GRM5 (0.62) GRM5PGRKCNH2
SCHEMBL5021769 0.76 GRM5 (0.55) GRM5PGRKCNH2
SCHEMBL13642152 0.74 GRM5 (0.53) GRM5
SCHEMBL5021545 0.74 GRM5 (0.53) GRM5PGRKCNH2

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
WO-2012064603-A1 OXAZOLIDINONES AS MODULATORS OF MGLUR5 BRISTOL-MYERS SQUIBB COMPANY (US) 2012-05-18 WO disclosed