SCHEMBL19568902

SCHEMBL19568902

COc1ccc(C(=O)NC2CC(C)(NC(=O)COc3ccc(Cl)c(F)c3)C2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 15/20 0.49
▸ ROCK2 O75116 1/20 0.44
▸ ROCK1 Q13464 1/20 0.44
▸ ACHE P22303 1/20 0.42
▸ KCNQ3 O43525 1/20 0.41
▸ KCNQ2 O43526 1/20 0.41
▸ EZH2 Q15910 1/20 0.40

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
SCHEMBL20992495 0.85 ATF4 (0.49) ATF4ROCK2ROCK1KCNQ3KCNQ2
SCHEMBL19568416 0.85 ATF4 (0.49) ATF4ROCK2ROCK1
SCHEMBL19568409 0.85 ATF4 (0.49) ATF4EZH2
SCHEMBL19568388 0.84 ATF4 (0.51) ATF4EZH2
SCHEMBL19556040 0.83 ATF4 (0.60) ATF4ROCK2ROCK1KCNQ3KCNQ2
SCHEMBL19568686 0.81 ATF4 (0.44) ATF4
SCHEMBL19568905 0.80 ATF4 (0.48) ATF4ROCK2ROCK1KCNQ3KCNQ2
SCHEMBL19568954 0.79 ATF4 (0.49) ATF4
SCHEMBL19569369 0.79 ATF4 (0.52) ATF4
SCHEMBL19568274 0.78 ATF4 (0.48) ATF4

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-2017193063-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES (US) 2017-11-09 — — WO disclosed
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