SCHEMBL19555498

SCHEMBL19555498

NC(=O)C(Oc1ccc(Cl)c(Cl)c1)C12CC(NC(=O)COCCc3cccc(F)c3)(C1)C2

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.39
▸ MAOA P21397 4/20 0.39
▸ ATF4 P18848 7/20 0.36
▸ PPARG P37231 2/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ HRH1 P35367 1/20 0.34
▸ CCR3 P51677 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33

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
SCHEMBL19555478 0.91 ATF4 (0.37) MAOBATF4PPARGPPARAHRH1
SCHEMBL19555474 0.88 CNR1 (0.34) ATF4PPARGPPARA
SCHEMBL19555452 0.85 ATF4 (0.36) ATF4HRH1CCR3
SCHEMBL30026044 0.85 ATF4 (0.50) MAOBMAOAATF4
SCHEMBL19569211 0.85 ATF4 (0.50) MAOBMAOAATF4
SCHEMBL19555489 0.84 ATF4 (0.40) ATF4PPARGPPARA
SCHEMBL19555488 0.83 ATF4 (0.38) MAOBATF4HRH1CCR3
SCHEMBL19555508 0.79 ATF4 (0.42) ATF4PPARGPPARASCN9A
SCHEMBL19569590 0.79 ATF4 (0.59) ATF4
SCHEMBL19555449 0.76 ATF4 (0.53) 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 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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