SCHEMBL30907394

SCHEMBL30907394

CCC[C@H](O)c1cc(C)c(-c2cc3cnc4[nH]ccc4c3cn2)cn1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CIT O14578 3/20 0.35
ABL1 P00519 4/20 0.35
AXL P30530 1/20 0.34
PRKCI P41743 1/20 0.34
JAK2 O60674 5/20 0.33
JAK1 P23458 4/20 0.33
NUDT1 P36639 2/20 0.33
RPS6KA3 P51812 1/20 0.32
CCNK O75909 1/20 0.32
CDK12 Q9NYV4 1/20 0.32
JAK3 P52333 3/20 0.32
CSNK1D P48730 1/20 0.32
MAPK14 Q16539 1/20 0.32
TYK2 P29597 2/20 0.32
ATR Q13535 1/20 0.31
LATS1 O95835 1/20 0.31
LATS2 Q9NRM7 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
SCHEMBL30907110 1.00 CIT (0.35) CITABL1AXLPRKCIJAK2
SCHEMBL30907449 1.00 CIT (0.35) CITABL1AXLPRKCIJAK2
SCHEMBL30907357 0.92 ABL1 (0.41) CITABL1AXLPRKCIJAK2
SCHEMBL30907471 0.92 ABL1 (0.41) CITABL1AXLPRKCIJAK2
SCHEMBL30907101 0.92 ABL1 (0.41) CITABL1AXLPRKCIJAK2
SCHEMBL30907489 0.78 GABRA1 (0.38) CITAXLPRKCIJAK2JAK1
SCHEMBL30907289 0.77 CIT (0.38) CITABL1AXLPRKCIJAK2
SCHEMBL30907158 0.76 ABL1 (0.46) ABL1
SCHEMBL30907626 0.76 ABL1 (0.38) ABL1
SCHEMBL30907404 0.76 ABL1 (0.38) 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