SCHEMBL21384529

SCHEMBL21384529

CC(=O)NC12CC(NC(=O)COC3CCC3)(C1)C2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 14/20 0.59
▸ ALDH1A1 P00352 3/20 0.33
▸ OPRK1 P41145 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL19568600 0.95 ATF4 (0.57) ATF4NPSR1
SCHEMBL21384535 0.84 ATF4 (0.59) ATF4ALDH1A1MEN1MAPTKMT2A
SCHEMBL23294682 0.83 ATF4 (0.56) ATF4ALDH1A1MEN1MAPTKMT2A
SCHEMBL20722058 0.82 ATF4 (0.53) ATF4ALDH1A1MEN1MAPTKMT2A
SCHEMBL20992777 0.82 ATF4 (0.56) ATF4NPSR1
SCHEMBL19568218 0.82 ATF4 (0.56) ATF4NPSR1
SCHEMBL19566748 0.82 ATF4 (0.56) ATF4NPSR1
SCHEMBL22627606 0.82 ATF4 (0.56) ATF4NPSR1
SCHEMBL22628041 0.82 ATF4 (0.56) ATF4NPSR1
SCHEMBL19568817 0.82 ATF4 (0.56) ATF4NPSR1

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
EP-3768660-A1 MODULATORS OF EUKARYOTIC INITIATION FACTOR 2 Denali Therapeutics Inc. (US) 2021-01-27 — — EP disclosed
WO-2019183589-A1 MODULATORS OF EUKARYOTIC INITIATION FACTOR 2 DENALI THERAPEUTICS INC. (US) 2019-09-26 — — WO disclosed
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