SCHEMBL20999635

SCHEMBL20999635

CC1(NC(=O)COc2ccc(Cl)c(F)c2)C=C(NC(=O)COCc2cccc(C#N)c2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 10/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GPR34 Q9UPC5 1/20 0.38
▸ KCNH2 Q12809 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ PDCD1 Q15116 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ FFAR1 O14842 2/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.36
▸ CETP P11597 1/20 0.35
▸ MAOB P27338 1/20 0.35

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
SCHEMBL22669323 0.91 ATF4 (0.47) ATF4GAACETPMAOB
SCHEMBL22669517 0.90 MAOB (0.44) ATF4MAOB
SCHEMBL22669289 0.90 ATF4 (0.43) ATF4MAOB
SCHEMBL20999255 0.89 ATF4 (0.43) ATF4FFAR1
SCHEMBL20999629 0.87 MRGPRX4 (0.45) ATF4
SCHEMBL22669473 0.87 ATF4 (0.41) ATF4
SCHEMBL19569203 0.85 ATF4 (0.59) ATF4SMN1; SMN2GPR34
SCHEMBL20999669 0.83 ATF4 (0.43) ATF4GAA
SCHEMBL20999212 0.83 ATF4 (0.43) ATF4
SCHEMBL22669532 0.83 MAOB (0.42) ATF4MAOB

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 1/4885SMN1; SMN2 2486/4885GPR34 3210/4885
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885SMN1; SMN2 2486/4885GPR34 3210/4885

“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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