SCHEMBL19555455

SCHEMBL19555455

CCc1nc(C)ccc1OCC(=O)NC12CC(C(Oc3ccc(Cl)c(F)c3)C(N)=O)(C1)C2

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 14/20 0.46
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TPH1 P17752 2/20 0.36
▸ TPH2 Q8IWU9 1/20 0.36
▸ S1PR4 O95977 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL19555467 0.93 ATF4 (0.47) ATF4
SCHEMBL19555501 0.93 ATF4 (0.48) ATF4
SCHEMBL19555512 0.93 ATF4 (0.47) ATF4
SCHEMBL19569599 0.88 ATF4 (0.59) ATF4KDM4EALDH1A1
SCHEMBL30025762 0.88 ATF4 (0.59) ATF4KDM4EALDH1A1
SCHEMBL19555514 0.88 ATF4 (0.47) ATF4
SCHEMBL19555487 0.87 ATF4 (0.52) ATF4
SCHEMBL19555477 0.86 ATF4 (0.47) ATF4
SCHEMBL19555458 0.84 ATF4 (0.47) ATF4
SCHEMBL19555457 0.82 ATF4 (0.43) 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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