SCHEMBL14149258

SCHEMBL14149258

Bc1cnn(C(C)(C)CO)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.43
KDM5B Q9UGL1 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35
ABL1 P00519 1/20 0.34
ALOX5AP P20292 2/20 0.32
FGFR1 P11362 1/20 0.31
FGFR2 P21802 1/20 0.31
FGFR3 P22607 1/20 0.31
MAP4K1 Q92918 1/20 0.31
LRRK2 Q5S007 1/20 0.30

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
SCHEMBL15382055 0.78 KIT (0.43) KITKDM5BJAK2JAK1TYK2
SCHEMBL1582031 0.77 KIT (0.43) KITKDM5BJAK2JAK1TYK2
SCHEMBL12019737 0.77 KIT (0.43) KITKDM5BJAK2JAK1TYK2
SCHEMBL17480021 0.76 KIT (0.42) KITKDM5BJAK2JAK1TYK2
SCHEMBL19531691 0.74 KDM5B (0.43) KITKDM5BJAK2JAK1TYK2
SCHEMBL24333809 0.73 KIT (0.40) KITKDM5BJAK2JAK1TYK2
SCHEMBL21850226 0.73 KIT (0.40) KITKDM5BJAK2JAK1TYK2
SCHEMBL16424234 0.70 F2 (0.40) KITKDM5B
SCHEMBL19539076 0.70 JAK2 (0.39) KITKDM5BJAK2JAK1TYK2
SCHEMBL16423979 0.69 ALDH1A1 (0.42) KITKDM5BMAP4K1

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-2008088881-A1 KINASE INHIBITOR COMPOUNDS XCOVERY, INC. (US) 2008-07-24 WO disclosed