SCHEMBL3469922

SCHEMBL3469922

CC(C)CNc1nccn2c(-c3cccs3)cnc12

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TTK P33981 11/20 0.56
FLT3 P36888 5/20 0.42
ADORA3 P0DMS8 2/20 0.42
FYN P06241 1/20 0.39
SRC P12931 1/20 0.39

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
SCHEMBL5619013 0.83 FLT3 (0.54) TTKFLT3ADORA3FYNSRC
SCHEMBL3467927 0.76 TTK (0.74) TTKFLT3
SCHEMBL9937301 0.76 TTK (0.57) TTKFLT3ADORA3
SCHEMBL3469505 0.75 TTK (0.57) TTKFLT3ADORA3
SCHEMBL3466151 0.75 TTK (0.62) TTKFLT3
SCHEMBL3466904 0.74 TTK (0.69) TTK
SCHEMBL3469482 0.74 TTK (0.71) TTKFLT3
SCHEMBL120443 0.74 KDM4E (0.46) ADORA3
SCHEMBL14573301 0.73 FYN (0.47) TTKADORA3FYN
SCHEMBL8249613 0.73 TTK (0.60) TTK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO claimed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO disclosed