SCHEMBL1979138

SCHEMBL1979138

CC#Cc1cc(Br)cc(C#N)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.40
ALB P02768 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PGR P06401 1/20 0.33
GRM5 P41594 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL504640 0.83 TTR (0.52) TTRALBMEN1KMT2APGR
SCHEMBL200313 0.78 TTR (0.52) TTRALBMEN1KMT2APGR
SCHEMBL28671409 0.75 CYP1A1 (0.43)
SCHEMBL31040201 0.74 GRM5 (0.33) GRM5
SCHEMBL1981891 0.74 GRM5 (0.33) GRM5
SCHEMBL29954891 0.74 ENPP2 (0.48) TTRALBMEN1KMT2AGRM5
SCHEMBL16951758 0.73 TTR (0.43) TTRALBMEN1KMT2APGR
SCHEMBL30345274 0.73 TTR (0.43) TTRALBMEN1KMT2APGR
SCHEMBL254589 0.73 TTR (0.43) TTRALBMEN1KMT2APGR
SCHEMBL3509168 0.73 TTR (0.43) TTRALBMEN1KMT2APGR

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-2011072064-A1 S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-06-16 WO disclosed