SCHEMBL25804598

SCHEMBL25804598

CNC12CCC(NC(=O)COc3ccc(Cl)c(Cl)c3)(C1)C2

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 15/20 0.61
▸ ALDH1A1 P00352 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL19569389 0.91 ATF4 (0.72) ATF4ALDH1A1GAA
SCHEMBL19555985 0.89 ATF4 (0.62) ATF4ALDH1A1GAA
SCHEMBL19569514 0.89 ATF4 (0.61) ATF4ALDH1A1GAA
SCHEMBL20973977 0.88 ATF4 (0.71) ATF4ALDH1A1GAA
SCHEMBL22668959 0.88 ATF4 (0.71) ATF4ALDH1A1GAA
SCHEMBL30075935 0.85 ATF4 (0.60) ATF4ALDH1A1GAAKDM4ELMNA
SCHEMBL19555380 0.85 ATF4 (0.57) ATF4ALDH1A1GAA
SCHEMBL22397093 0.85 ATF4 (0.63) ATF4ALDH1A1GAA
SCHEMBL30025947 0.85 ATF4 (0.63) ATF4ALDH1A1GAA
SCHEMBL19555519 0.84 ATF4 (0.56) ATF4ALDH1A1GAA

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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