SCHEMBL30489409

SCHEMBL30489409

CCc1cncc(C(=O)NC23CC(NC(=O)COc4ccc(Cl)c(Cl)c4)(C2)C3)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 16/20 0.48
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ SMYD3 Q9H7B4 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
SCHEMBL22437015 1.00 ATF4 (0.48) ATF4ALDH1A1GAASMYD3
SCHEMBL22437058 0.92 ATF4 (0.57) ATF4
SCHEMBL19555818 0.91 ATF4 (0.47) ATF4
SCHEMBL19556437 0.88 ATF4 (0.50) ATF4
SCHEMBL22436941 0.85 ATF4 (0.47) ATF4ALDH1A1GAA
SCHEMBL19556260 0.84 ATF4 (0.50) ATF4ALDH1A1GAA
SCHEMBL19569117 0.83 SMYD3 (0.47) ATF4ALDH1A1GAASMYD3
SCHEMBL19555798 0.83 KDM4E (0.52) ATF4ALDH1A1GAA
SCHEMBL19556117 0.83 ATF4 (0.58) ATF4
SCHEMBL19556284 0.83 ATF4 (0.55) 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
EP-3452456-B1 BICYCLIC MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2023-07-05 — — EP disclosed
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