SCHEMBL19555474

SCHEMBL19555474

CN(C)c1cccc(CCOCC(=O)NC23CC(C(Oc4ccc(Cl)c(Cl)c4)C(N)=O)(C2)C3)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.34
▸ ATF4 P18848 6/20 0.33
▸ ATM Q13315 1/20 0.33
▸ FFAR1 O14842 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ FDFT1 P37268 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30

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
SCHEMBL19555489 0.93 ATF4 (0.40) CNR1ATF4PPARGPPARA
SCHEMBL19555498 0.88 MAOB (0.39) ATF4PPARGPPARA
SCHEMBL19569284 0.86 ATF4 (0.46) CNR1ATF4ATM
SCHEMBL30025580 0.86 ATF4 (0.46) CNR1ATF4ATM
SCHEMBL19555452 0.85 ATF4 (0.36) ATF4FFAR1SLC6A4
SCHEMBL19555508 0.84 ATF4 (0.42) ATF4PPARGPPARA
SCHEMBL19555478 0.83 ATF4 (0.37) ATF4FFAR1PPARGPPARA
SCHEMBL22668962 0.79 ATF4 (0.43) CNR1ATF4ALDH1A1GAAALOX15
SCHEMBL19569435 0.78 ATF4 (0.54) ATF4
SCHEMBL19555488 0.76 ATF4 (0.38) ATF4ALDH1A1

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-3452448-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2019-03-13 — — EP disclosed
WO-2017193034-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES (US) 2017-11-09 — — WO disclosed
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