SCHEMBL1502946

SCHEMBL1502946

CCC1CCCCN1c1ccc2c(n1)n(C)c(=O)n2CC1(C)CC1(F)F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.49
HSD17B10 Q99714 4/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 4/20 0.38
ALDH1A1 P00352 6/20 0.36
NPSR1 Q6W5P4 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP3A4 P08684 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL1502970 0.84 GRM2 (0.50) GRM2HSD17B10LMNATP53TSHR
SCHEMBL1503055 0.81 GRM2 (0.73) GRM2CYP3A4
SCHEMBL6890799 0.80 GRM2 (0.62) GRM2HSD17B10LMNATP53TSHR
SCHEMBL15168601 0.76 GRM2 (0.46) GRM2
SCHEMBL15168876 0.74 PARG (0.39) GRM2LMNANPSR1MAPTHTT
SCHEMBL1503008 0.74 GRM2 (0.70) GRM2CYP3A4
SCHEMBL6891306 0.72 GRM2 (0.52) GRM2TSHRALDH1A1SMN1; SMN2KMT2A
SCHEMBL6893791 0.72 GRM2 (0.52) GRM2TSHRALDH1A1SMN1; SMN2KMT2A
SCHEMBL6892255 0.72 GRM2 (0.52) GRM2TSHRALDH1A1SMN1; SMN2KMT2A
SCHEMBL6890927 0.71 GRM2 (0.75) GRM2CYP3A4

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