SCHEMBL3467008

SCHEMBL3467008

CN1CCN(c2nccn3c(-c4cccc(OC(F)(F)F)c4)cnc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 12/20 0.48
DYRK1A Q13627 2/20 0.46
PIM1 P11309 3/20 0.45
GAK O14976 1/20 0.45
STK10 O94804 1/20 0.45
YES1 P07947 1/20 0.45
RET P07949 1/20 0.45
PDGFRB P09619 1/20 0.45
CSNK2A2 P19784 1/20 0.45
ACVR1 Q04771 1/20 0.45
KCNH2 Q12809 1/20 0.45
PKN1 Q16512 1/20 0.45
PIM3 Q86V86 1/20 0.45
HASPIN Q8TF76 1/20 0.45
SIK2 Q9H0K1 1/20 0.45
SLK Q9H2G2 1/20 0.45
BMP2K Q9NSY1 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
PRKAG2 Q9UGJ0 1/20 0.45
RPS6KA6 Q9UK32 1/20 0.45

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
SCHEMBL3469763 0.88 DYRK1A (0.57) DYRK1APIM1PIM3PIM2PDE5A
SCHEMBL5400838 0.78 DYRK1A (0.50) FLT3DYRK1APIM1
SCHEMBL3470660 0.76 FYN (0.54) FLT3PDE5APDE6APDE1BPDE3A
SCHEMBL3467938 0.76 PDE5A (0.67) PDE5APDE6APDE1BPDE3A
SCHEMBL3469421 0.72 FLT3 (0.54) FLT3
SCHEMBL16331409 0.72 KCNH2 (0.59) DYRK1APIM1KCNH2
SCHEMBL3466944 0.71 DYRK1A (0.44) DYRK1A
SCHEMBL17907585 0.71 FLT3 (0.73) FLT3
SCHEMBL3466485 0.70 GRIA1 (0.60) PDE5APDE6APDE1BPDE3A
SCHEMBL12272445 0.70 FLT3 (0.66) FLT3

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