SCHEMBL23357893

SCHEMBL23357893

COCCNC(=O)OCC(=O)NC12CC(NC(=O)COc3ccc(Cl)cc3)(C1)C2

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 10/20 0.67
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ HPGD P15428 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KDM4E B2RXH2 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
SCHEMBL23383884 0.84 ATF4 (0.70) ATF4CYP1A2CYP2C9CYP2C19MEN1
SCHEMBL20610418 0.84 ATF4 (0.78) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL20610358 0.84 ATF4 (0.86) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL20610321 0.83 ATF4 (0.76) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL20974142 0.82 ATF4 (1.00) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL20610381 0.80 ATF4 (0.89) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL10090174 0.80 CYP1A2 (0.70) CYP1A2CYP2C9CYP2C19HPGDMEN1
SCHEMBL20610318 0.79 ATF4 (0.86) ATF4MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL19569416 0.79 ATF4 (0.86) ATF4CYP1A2MEN1ALDH1A1KMT2A
SCHEMBL20610367 0.79 ATF4 (0.86) ATF4MEN1ALDH1A1KMT2AL3MBTL1

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-20210145771-A1 N-(3-(2-(4-CHLOROPHENOXY)ACETAMIDO)BICYCLO[1.1.1] PENTAN-1-YL)-2-CYCLOBUTANE-1- CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ATF4 INHIBITORS FOR TREATING CANCER AND OTHER DISEASES GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-05-20 — — 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-20210145771-A1 N-(3-(2-(4-CHLOROPHENOXY)ACETAMIDO)BICYCLO[1.1.1] PENTAN-1-YL)-2-CYCLOBUTANE-1- CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ATF4 INHIBITORS FOR TREATING CANCER AND OTHER DISEASES ATF4, EIF2B1, EIF4A1 ATF4 1/4885CYP1A2 2327/4885CYP2C9 3589/4885

“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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