SCHEMBL20999208

SCHEMBL20999208

CC1(NC(=O)COc2ccc(Cl)c(F)c2)C=C(NC(=O)CCCOc2cccc(Cl)c2)C1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 9/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ PPARG P37231 1/20 0.44
▸ PPARD Q03181 1/20 0.44
▸ MAPT P10636 1/20 0.42

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
SCHEMBL22668975 0.96 MAPT (0.46) ATF4FFAR1PPARGPPARDMAPT
SCHEMBL22669127 0.93 ATF4 (0.48) ATF4FFAR1PPARGPPARDMAPT
SCHEMBL20999051 0.92 ALDH1A1 (0.41) PPARGPPARDMAPT
SCHEMBL20999043 0.88 MAPT (0.42) MAPT
SCHEMBL22669532 0.87 MAOB (0.42) ATF4MAPT
SCHEMBL19569441 0.86 ATF4 (0.50) ATF4FFAR1PPARGPPARD
SCHEMBL20999053 0.84 ALDH1A1 (0.47) MAPT
SCHEMBL22669121 0.84 ATF4 (0.42) ATF4
SCHEMBL22669517 0.84 MAOB (0.44) ATF4
SCHEMBL20999049 0.83 ATF4 (0.51) 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
US-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 — — US disclosed
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2019-05-16 — — 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 (2 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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885FFAR1 1632/4885PPARG 724/4885
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885FFAR1 1632/4885PPARG 724/4885

“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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