SCHEMBL24866938

SCHEMBL24866938

O=C(c1cnc(Nc2ccc(C3CCOCC3)cc2)nc1)c1ccncc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 7/20 0.42
SYK P43405 2/20 0.42
FLT3 P36888 6/20 0.41
KIT P10721 5/20 0.41
ULK1 O75385 1/20 0.41
NAMPT P43490 2/20 0.40
AURKA O14965 1/20 0.39
EGFR P00533 1/20 0.39
NTRK1 P04629 1/20 0.39
CDK1 P06493 1/20 0.39
IGF1R P08069 1/20 0.39
EPHA1 P21709 1/20 0.39
CDK2 P24941 1/20 0.39
BMX P51813 1/20 0.39
JAK3 P52333 1/20 0.39
CDK6 Q00534 1/20 0.39
PAK1 Q13153 1/20 0.39
ALK Q9UM73 1/20 0.39

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
SCHEMBL24867279 0.81 SYK (0.45) SYKNAMPT
SCHEMBL24867266 0.81 PTK2 (0.39) PTK2SYKFLT3
SCHEMBL24866939 0.75 VNN1 (0.41) PTK2FLT3KITNTRK1
SCHEMBL24867271 0.67 SYK (0.40) SYKNAMPTCDK1CDK2
SCHEMBL763226 0.67 SYK (0.73) SYK
SCHEMBL14667302 0.65 SYK (0.58) SYKAURKAEGFRIGF1RJAK3
SCHEMBL24867207 0.64 SCN5A (0.46)
SCHEMBL24867489 0.64 CDK2 (0.38) SYKIGF1RCDK2
SCHEMBL5099923 0.63 GAA (0.50)
SCHEMBL4403243 0.63 SYK (0.52) SYKJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023283488-A9 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CZ BIOHUB SF, LLC (US) 2023-05-25 WO disclosed
WO-2023283488-A2 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2023-01-12 WO disclosed