SCHEMBL3467764

SCHEMBL3467764

CC(=O)Nc1cccc(-c2cnc3c(Nc4cccc(F)c4)nccn23)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 2/20 0.48
CCNT1 O60563 2/20 0.48
CCNA2 P20248 2/20 0.48
CDK2 P24941 2/20 0.48
CDK9 P50750 2/20 0.48
CDK5 Q00535 2/20 0.48
DYRK1A Q13627 2/20 0.48
CDK5R1 Q15078 2/20 0.48
DYRK2 Q92630 2/20 0.48
DYRK1B Q9Y463 2/20 0.48
BRAF P15056 1/20 0.48
TTK P33981 2/20 0.47
FYN P06241 11/20 0.47
IDO1 P14902 1/20 0.45
FGFR3 P22607 1/20 0.44
KDR P35968 1/20 0.44
PIK3C3 Q8NEB9 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43

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
SCHEMBL3466056 0.90 TTK (0.57) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3469213 0.88 FYN (0.55) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3466661 0.86 BRAF (0.52) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL5416134 0.86 FYN (0.54) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3467351 0.84 FYN (0.55) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3466123 0.83 BRAF (0.53) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3466122 0.83 TTK (0.55) DYRK3CCNT1CCNA2CDK2CDK9
SCHEMBL3470453 0.82 TTK (0.64) BRAFTTKFYN
SCHEMBL14767444 0.82 TTK (0.54) BRAFTTKFYNIDO1ABCG2
SCHEMBL3466505 0.81 FYN (0.58) DYRK3CCNT1CCNA2CDK2CDK9

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