SCHEMBL3469478

SCHEMBL3469478

FC(F)C(F)(F)Oc1cccc(Nc2nccn3c(-c4cccc(OC(F)(F)F)c4)cnc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.44
BCR P11274 2/20 0.44
PRKCA P17252 2/20 0.44
DYRK1A Q13627 6/20 0.44
SYK P43405 1/20 0.44
EPHX2 P34913 1/20 0.41
CCNB2 O95067 1/20 0.41
CCNE2 O96020 1/20 0.41
CDK1 P06493 1/20 0.41
FGFR1 P11362 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41
CCNA2 P20248 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR4 P22455 1/20 0.41
FGFR3 P22607 1/20 0.41
CCND1 P24385 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
CCND2 P30279 1/20 0.41

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
SCHEMBL3469414 0.91 ABL1 (0.43) ABL1BCRPRKCADYRK1ASYK
SCHEMBL3466944 0.88 DYRK1A (0.44) ABL1BCRDYRK1ASYKCTSC
SCHEMBL5400838 0.82 DYRK1A (0.50) DYRK1AFYNADORA3PIM1
SCHEMBL12409291 0.81 PIM1 (0.46) ABL1BCRPRKCACCNB2CCNE2
SCHEMBL3466346 0.79 TTK (0.45) SYKCTSCTTKFYN
SCHEMBL3467043 0.78 ABCG2 (0.54) ABL1BCRSYKBRAFFYN
SCHEMBL3467726 0.78 TTK (0.57) ABL1BCREPHX2CTSCTTK
SCHEMBL14767492 0.76 PIM1 (0.45) ABL1BCRCTSCBRAFTTK
SCHEMBL3471147 0.76 MAPK1 (0.56) DYRK1ABRAFTTKFYN
SCHEMBL13344064 0.74 CCNB2 (0.43) ABL1BCRPRKCASYKEPHX2

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