SCHEMBL30907372

SCHEMBL30907372

CC(=O)c1cc(C)c(-c2cnc3cc(Cl)ncc3c2)cn1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.42
S1PR2 O95136 1/20 0.34
MAP4K4 O95819 1/20 0.33
CSNK1G2 P78368 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
MAP4K5 Q9Y4K4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GPBAR1 Q8TDU6 2/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
LCK P06239 1/20 0.31
KDR P35968 1/20 0.31
JAK3 P52333 1/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL30907125 0.86 ABL1 (0.42) ABL1
SCHEMBL30907424 0.86 ABL1 (0.42) ABL1
SCHEMBL30907495 0.85 ABL1 (0.42) ABL1LCKKDRJAK3MAPK14
SCHEMBL30907308 0.84 ABL1 (0.39) ABL1
SCHEMBL30907652 0.79 GSK3B (0.47) ABL1
SCHEMBL30907625 0.76 ABL1 (0.56) ABL1
SCHEMBL30907359 0.72 ABL1 (0.42) ABL1
SCHEMBL15270456 0.70 ABL1 (0.40) ABL1ALDH1A1LCKKDRJAK3
SCHEMBL30907451 0.70 ABL1 (0.39) ABL1
SCHEMBL30907381 0.70 ABL1 (0.32) ABL1

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-2024097953-A1 NAPHTHYRIDINE COMPOUNDS FOR INHIBITION OF RAF KINASES ENLIVEN INC. (US) 2024-05-10 WO disclosed