SCHEMBL3466587

SCHEMBL3466587

CNS(=O)(=O)c1cccc(-c2cnc3c(Nc4cccc(C(F)(F)F)c4)nccn23)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
TNNI3K Q59H18 4/20 0.51
BRAF P15056 2/20 0.51
LMNA P02545 3/20 0.44
AR P10275 1/20 0.44
AURKA O14965 1/20 0.43
POLB P06746 1/20 0.43
EGFR P00533 1/20 0.43
SYK P43405 1/20 0.41
ABL1 P00519 2/20 0.41
KIT P10721 2/20 0.41
BCR P11274 2/20 0.41
DDR1 Q08345 2/20 0.41
DDR2 Q16832 2/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.40
GMNN O75496 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TTR P02766 1/20 0.40

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
SCHEMBL3467002 0.82 LMNA (0.54) BRAFLMNAPOLBSYKABL1
SCHEMBL3466303 0.82 GAA (0.53) MAPTBRAFLMNAARPOLB
SCHEMBL3469213 0.82 FYN (0.55) BRAFLMNAPOLBSYKABL1
SCHEMBL3467043 0.81 ABCG2 (0.54) MAPTBRAFLMNAPOLBEGFR
SCHEMBL3465711 0.81 SYK (0.45) MAPTBRAFLMNAARPOLB
SCHEMBL3465798 0.80 BRAF (0.51) BRAFLMNAARAURKAPOLB
SCHEMBL3466944 0.80 DYRK1A (0.44) BRAFLMNAARPOLBSYK
SCHEMBL3465843 0.80 LMNA (0.43) MAPTBRAFLMNAARPOLB
SCHEMBL3466290 0.80 KIT (0.46) BRAFLMNAPOLBSYKABL1
SCHEMBL3466278 0.79 FYN (0.47) MAPTBRAFLMNAAURKAPOLB

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