SCHEMBL20610411

SCHEMBL20610411

O=C(COc1ccc(Cl)cc1)NC12CC(NC(=O)CC(F)(F)F)(C1)C2

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 16/20 0.80
▸ KCNH2 Q12809 1/20 0.52
▸ NPC1 O15118 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL20974142 0.89 ATF4 (1.00) ATF4KCNH2NPC1TSHRRAB9A
SCHEMBL20610334 0.88 ATF4 (0.76) ATF4KCNH2NPC1TSHRRAB9A
SCHEMBL20610403 0.87 ATF4 (0.80) ATF4KCNH2NPC1TSHRRAB9A
SCHEMBL19569423 0.85 ATF4 (0.86) ATF4KCNH2NPC1TSHRRAB9A
SCHEMBL20610326 0.84 ATF4 (0.74) ATF4KCNH2NPSR1
SCHEMBL23149137 0.84 ATF4 (0.89) ATF4NPC1TSHRRAB9ANPSR1
SCHEMBL20610381 0.84 ATF4 (0.89) ATF4NPC1TSHRRAB9ANPSR1
SCHEMBL19556192 0.84 ATF4 (0.89) ATF4NPC1TSHRRAB9ANPSR1
SCHEMBL19569398 0.84 ATF4 (1.00) ATF4NPC1TSHRRAB9ANPSR1
SCHEMBL19569281 0.84 ATF4 (0.94) ATF4NPC1TSHRRAB9ANPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649106-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) 2020-05-13 — — EP claimed
WO-2019008506-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) 2019-01-10 — — WO claimed
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 1/4885KCNH2 4344/4885NPC1 909/4885

“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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