SCHEMBL4100087

SCHEMBL4100087

C(#CC12CC3CC(c4ccccc4)(C1)CC(c1ccccc1)(C3)C2)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.41
GRIN3B O60391 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
GRIN3A Q8TCU5 2/20 0.41
PGR P06401 4/20 0.33
APP P05067 1/20 0.33
HSD11B1 P28845 1/20 0.32
GRM5 P41594 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAOB P27338 4/20 0.30
MAOA P21397 3/20 0.30
PNMT P11086 1/20 0.30

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
SCHEMBL2746653 0.87 PGR (0.40) PGRHSD11B1GRM5
SCHEMBL4104803 0.86 GRIN2D (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4100078 0.85 APP (0.42) APPHSD11B1GRM5ALDH1A1MAOB
SCHEMBL6939188 0.79 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2190267 0.79 APP (0.37) APPGRM5
SCHEMBL2191510 0.78 APP (0.35) APPGRM5PNMT
SCHEMBL2187622 0.76 GRM5 (0.35) APPGRM5
SCHEMBL4104795 0.75 APP (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2747858 0.74 APP (0.42) APPHSD11B1GRM5
SCHEMBL2186702 0.74 APP (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
US-20090104371-A1 FILM FORMING COMPOSITION, METHOD FOR PRODUCING FILM, FILM, AND INSULATING FILM FUJIFILM CORPORATION (JP) 2009-04-23 US disclosed