SCHEMBL24277995

SCHEMBL24277995

CC(C)(C)OC(=O)N1CCC(c2cc(Nc3cc(C#N)ccn3)nc(N3CCC(F)(F)C3)c2)CC1

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 17/20 0.80
DLK1 P80370 2/20 0.80
DRG1 Q9Y295 1/20 0.80
MAP3K13 O43283 1/20 0.66
MAPK8 P45983 1/20 0.66
MAPK9 P45984 1/20 0.66
MAPK10 P53779 1/20 0.66
MAP3K9 P80192 1/20 0.66
MAP3K10 Q02779 1/20 0.66
MAP3K11 Q16584 1/20 0.66
GPR119 Q8TDV5 2/20 0.44
SYK P43405 1/20 0.43

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
SCHEMBL29474403 1.00 MAP3K12 (0.80) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL29474404 1.00 MAP3K12 (0.80) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL19821519 0.90 MAP3K12 (0.67) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL19826873 0.89 MAP3K12 (0.81) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL24278189 0.87 MAP3K12 (0.84) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL24278046 0.86 MAP3K12 (0.82) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL24278190 0.85 MAP3K12 (0.81) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL29474402 0.84 MAP3K12 (0.79) MAP3K12DLK1DRG1MAP3K13MAPK8
SCHEMBL15602522 0.83 MAP3K12 (0.62) MAP3K12DLK1DRG1GPR119SYK
Oxalic Acid SCHEMBL29474399 0.83 MAP3K12 (0.77) MAP3K12DLK1DRG1MAP3K13MAPK8

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-2022051326-A1 LZK‑TARGETING DEGRADERS AND METHODS OF USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-03-10 WO disclosed