SCHEMBL25258116

SCHEMBL25258116

O=C(O)Nc1ccc(-c2cn(Cc3ccc(-c4nnc(C(F)F)o4)cn3)cn2)cn1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 16/20 0.48
▸ HDAC1 Q13547 6/20 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
SCHEMBL25215918 0.92 HDAC6 (0.46) HDAC6HDAC1
SCHEMBL26235661 0.90 HDAC6 (0.44) HDAC6HDAC1
SCHEMBL30552410 0.87 HDAC6 (0.47) HDAC6HDAC1
SCHEMBL26235652 0.87 HDAC6 (0.47) HDAC6HDAC1
SCHEMBL26227434 0.85 HDAC6 (0.51) HDAC6HDAC1
SCHEMBL29403054 0.85 HDAC6 (0.63) HDAC6HDAC1
SCHEMBL24216493 0.85 HDAC6 (0.63) HDAC6HDAC1
SCHEMBL25208787 0.83 HDAC6 (0.51) HDAC6HDAC1
SCHEMBL30425036 0.83 HDAC6 (0.51) HDAC6HDAC1
SCHEMBL29022636 0.81 HDAC6 (0.48) HDAC6HDAC1

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-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-09-14 — — US disclosed
EP-4192830-A1 2-(4-((5-(BENZO[B]THIOPHEN-3-YL)-1H-TETRAZOL-1-YL)METHYL)PHENYL)-5-(DIFLUOROMETHYL)-1,3,4-OXADIAZOLE DERIVATIVES AND SIMILAR COMPOUNDS AS SELECTIVE INHIBITORS OF HISTONE DEACETYLASE 6 (HDAC6) FOR USE IN TREATING E.G. PERIPHERAL NEUROPATHY Italfarmaco SpA (IT) 2023-06-14 — — EP 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-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS HDAC6, HDAC1, HDAC3 HDAC6 1/4885HDAC1 2/4885

“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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