SCHEMBL24251908

SCHEMBL24251908

Cc1cn(C2CCN(C)C2)c2ncnc(N)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.48
RIPK2 O43353 4/20 0.47
SRC P12931 10/20 0.45
ABL1 P00519 7/20 0.45
FGFR1 P11362 3/20 0.45
MAP4K4 O95819 2/20 0.45
PAK4 O96013 2/20 0.45
LCK P06239 2/20 0.45
FYN P06241 2/20 0.45
CSF1R P07333 2/20 0.45
RET P07949 2/20 0.45
FLT1 P17948 2/20 0.45
KDR P35968 2/20 0.45
FLT3 P36888 2/20 0.45
CSNK1A1 P48729 2/20 0.45
LIMK1 P53667 2/20 0.45
MAP4K2 Q12851 2/20 0.45
ROCK1 Q13464 2/20 0.45
NTRK3 Q16288 2/20 0.45
NTRK2 Q16620 2/20 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
SCHEMBL24651203 0.92 ABL1 (0.49) ADKRIPK2SRCABL1FGFR1
SCHEMBL14644244 0.92 RIPK2 (0.52) ADKRIPK2SRCABL1FGFR1
SCHEMBL14643787 0.89 ADK (0.52) ADKRIPK2SRCABL1FGFR1
SCHEMBL16236916 0.86 MTOR (0.50) ADKRIPK2SRCABL1FGFR1
SCHEMBL24072104 0.84 RIPK2 (0.61) ADKRIPK2SRCABL1FGFR1
SCHEMBL19264162 0.82 SRC (0.61) ADKRIPK2SRCABL1FGFR1
SCHEMBL13020153 0.79 SRC (0.58) RIPK2SRCABL1FGFR1MAP4K4
SCHEMBL16236082 0.79 ABL1 (0.48) ADKSRCABL1FGFR1MAP4K4
SCHEMBL30120727 0.79 ABL1 (0.48) ADKSRCABL1FGFR1MAP4K4
SCHEMBL10261381 0.78 FGR (0.57) ADKRIPK2SRCABL1FGFR1

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-2022033532-A1 FGFR AND MUTATION INHIBITOR THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海和誉生物医药科技有限公司 2022-02-17 WO disclosed