SCHEMBL5022138

SCHEMBL5022138

O=C1N[C@H](c2cccnc2)[C@@H](c2cccnc2)O1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 19/20 0.55
PARP1 P09874 1/20 0.43

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
SCHEMBL5022139 1.00 GRM5 (0.55) GRM5PARP1
SCHEMBL5021735 0.88 GRM5 (0.71) GRM5
SCHEMBL4535429 0.86 GRM5 (0.50) GRM5
SCHEMBL4535428 0.86 GRM5 (0.50) GRM5
SCHEMBL4535433 0.86 GRM5 (0.50) GRM5
SCHEMBL5022132 0.85 GRM5 (0.53) GRM5
SCHEMBL13642285 0.85 GRM5 (0.53) GRM5
SCHEMBL16363844 0.84 GRM5 (0.58) GRM5
SCHEMBL16364182 0.84 GRM5 (0.58) GRM5
SCHEMBL15676069 0.83 GRM5 (0.46) GRM5

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