SCHEMBL10036375

SCHEMBL10036375

CCn1c(NC2CCOCC2)nc(Nc2ccc(C3CCNCC3)c(OC)c2)c(C(N)=O)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.49
KIT P10721 1/20 0.49
AXL P30530 8/20 0.44
EML4 Q9HC35 6/20 0.44
ALK Q9UM73 6/20 0.44
RET P07949 5/20 0.44
ROS1 P08922 5/20 0.44
ETV6 P41212 5/20 0.44
BMPR1B O00238 1/20 0.44
PLK4 O00444 1/20 0.44
CIT O14578 1/20 0.44
AURKA O14965 1/20 0.44
GAK O14976 1/20 0.44
EPHB6 O15197 1/20 0.44
RIPK2 O43353 1/20 0.44
BUB1 O43683 1/20 0.44
SNRNP200 O75643 1/20 0.44
STK16 O75716 1/20 0.44
STK10 O94804 1/20 0.44
MAP4K4 O95819 1/20 0.44

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
SCHEMBL10036189 0.82 EML4 (0.51) FLT3AXLEML4ALKRET
SCHEMBL283491 0.74 ALK (0.67) FLT3KITEML4ALKRET
SCHEMBL283492 0.74 ALK (0.67) FLT3KITEML4ALKRET
SCHEMBL10036188 0.73 FLT3 (0.43) FLT3KITAXLEML4ALK
SCHEMBL10036191 0.72 SYK (0.44) FLT3KITAXLEML4ALK
SCHEMBL31257919 0.69 FLT3 (0.89) FLT3KITAXLEML4ALK
SCHEMBL16305371 0.69 FLT3 (0.89) FLT3KITAXLEML4ALK
SCHEMBL10036374 0.68 PDE7A (0.45) FLT3AXLEML4ALKRET
SCHEMBL10156904 0.67 ALK (0.50) FLT3KITAXLEML4ALK
SCHEMBL25649977 0.66 FLT3 (0.68) FLT3KITAXLEML4ALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012053606-A1 ARYLAMINOHETEROCYCLIC CARBOXAMIDE COMPOUND アステラス製薬株式会社 (JP) 2012-04-26 WO disclosed