SCHEMBL22669532

SCHEMBL22669532

CC1(NC(=O)COc2ccc(Cl)c(F)c2)C=C(NC(=O)CCOCc2cccc(Cl)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.42
▸ ATF4 P18848 12/20 0.42
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ MAOA P21397 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 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
SCHEMBL22669517 0.93 MAOB (0.44) MAOBATF4HTTMAOA
SCHEMBL22669230 0.93 HTT (0.39) MAOBHTTMAOA
SCHEMBL22668975 0.89 MAPT (0.46) ATF4MAPTMEN1KMT2A
SCHEMBL22669121 0.88 ATF4 (0.42) MAOBATF4HTT
SCHEMBL20999208 0.87 ATF4 (0.44) ATF4MAPT
SCHEMBL19569460 0.87 ATF4 (0.47) MAOBATF4HTTMAOA
SCHEMBL22669127 0.86 ATF4 (0.48) ATF4MAPT
SCHEMBL22669289 0.86 ATF4 (0.43) MAOBATF4MAOA
SCHEMBL20999610 0.86 MAOB (0.44) MAOBATF4HTTMAOA
SCHEMBL20999255 0.85 ATF4 (0.43) ATF4MEN1KMT2A

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 MAOB 2933/4885ATF4 1/4885MAPT 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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