SCHEMBL6893917

SCHEMBL6893917

Cn1c(=O)n(CC2CC2(F)F)c2ccc(N3CC4CCC3CN4C(=O)c3ccon3)nc21

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 18/20 0.75
CYP3A4 P08684 1/20 0.75
PARG Q86W56 2/20 0.33

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
SCHEMBL6891675 0.90 GRM2 (0.80) GRM2CYP3A4
SCHEMBL6891464 0.88 GRM2 (0.78) GRM2CYP3A4PARG
SCHEMBL6892175 0.86 GRM2 (0.77) GRM2CYP3A4
SCHEMBL6892895 0.85 GRM2 (1.00) GRM2CYP3A4
SCHEMBL6893813 0.83 GRM2 (0.83) GRM2CYP3A4
SCHEMBL6891655 0.82 GRM2 (0.76) GRM2CYP3A4PARG
SCHEMBL6891488 0.79 GRM2 (0.88) GRM2CYP3A4
SCHEMBL6891383 0.79 GRM2 (0.88) GRM2CYP3A4
SCHEMBL14299777 0.79 GRM2 (1.00) GRM2CYP3A4PARG
SCHEMBL6894141 0.75 GRM2 (0.70) GRM2CYP3A4PARG

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-2011034741-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-03-24 WO disclosed