SCHEMBL20992457

SCHEMBL20992457

CCCCc1ccc(C(=O)NC23CC(C2)[C@@H](NC(=O)COc2ccc(Cl)c(F)c2)C3)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 18/20 0.42
▸ BACE1 P56817 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ THPO P40225 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL25796821 1.00 ATF4 (0.42) ATF4BACE1KDM4EMEN1ALDH1A1
SCHEMBL19568243 0.94 ATF4 (0.46) ATF4BACE1KDM4EMEN1ALDH1A1
SCHEMBL25781360 0.92 ATF4 (0.45) ATF4MEN1MAPTKMT2A
SCHEMBL25812918 0.92 ATF4 (0.45) ATF4MEN1MAPTKMT2A
SCHEMBL19568245 0.87 ATF4 (0.46) ATF4BACE1
SCHEMBL25796911 0.87 ATF4 (0.46) ATF4
SCHEMBL25812841 0.86 ATF4 (0.44) ATF4BACE1KDM4EMEN1ALDH1A1
SCHEMBL19555878 0.86 ATF4 (0.55) ATF4BACE1KDM4EMEN1ALDH1A1
SCHEMBL25780979 0.86 ATF4 (0.48) ATF4ALDH1A1
SCHEMBL20992782 0.85 ATF4 (0.45) ATF4BACE1

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
US-20190135772-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2019-05-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190135772-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885BACE1 3967/4885KDM4E 4646/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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