SCHEMBL22669323

SCHEMBL22669323

CC1(NC(=O)COc2ccc(Cl)c(F)c2)C=C(NC(=O)COCc2ccc(C#N)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 15/20 0.47
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ CETP P11597 1/20 0.37
▸ MAOB P27338 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
SCHEMBL20999635 0.91 ATF4 (0.46) ATF4GAACETPMAOB
SCHEMBL20999212 0.88 ATF4 (0.43) ATF4POLBKMT2AHRH3
SCHEMBL20999064 0.85 ATF4 (0.47) ATF4GAAKMT2ACETP
SCHEMBL22669517 0.85 MAOB (0.44) ATF4MAOB
SCHEMBL20999669 0.85 ATF4 (0.43) ATF4POLBMAPTGAA
SCHEMBL22669289 0.85 ATF4 (0.43) ATF4MAOB
SCHEMBL22668967 0.85 HPGD (0.40) ATF4POLBMAPTGAAKMT2A
SCHEMBL19569210 0.84 ATF4 (0.61) ATF4
SCHEMBL20999255 0.84 ATF4 (0.43) ATF4POLBKMT2A
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 1 patent. 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

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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885POLB 1764/4885MAPT 3293/4885

“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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