SCHEMBL6920958

SCHEMBL6920958

CCCCN1CCn2c(nc3cc(-c4cccc(F)c4)ccc3c2=O)C1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 0.45
BCL2A1 Q16548 2/20 0.40
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
TGFBR1 P36897 1/20 0.37

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
SCHEMBL6921795 0.88 GRM2 (0.46) GRM2BCL2A1KCNH2
SCHEMBL6922513 0.87 RXFP1 (0.45) GRM2KCNH2HRH3
SCHEMBL6922768 0.86 GRM5 (0.46) GRM2ADORA2AADORA1
SCHEMBL6922377 0.84 LMNA (0.41) GRM2BCL2A1TGFBR1
SCHEMBL6922267 0.83 GRM2 (0.48) GRM2BCL2A1ADORA2AADORA1
SCHEMBL6923595 0.83 GRM2 (0.41) GRM2BCL2A1
SCHEMBL6923042 0.82 RAB9A (0.39) GRM2BCL2A1
SCHEMBL6923502 0.80 BCL2A1 (0.37) GRM2BCL2A1
SCHEMBL6922766 0.80 ADORA2A (0.46) GRM2ADORA2AADORA1
SCHEMBL12058968 0.79 LMNA (0.47)

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-2011075699-A2 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2011-06-23 WO disclosed