SCHEMBL24599274

SCHEMBL24599274

COc1cccc(-c2cn(Cc3ccc(-c4nnc(C(F)F)o4)cn3)nn2)c1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 11/20 0.73
▸ GPR55 Q9Y2T6 1/20 0.46
▸ CD74 P04233 1/20 0.45
▸ MIF P14174 1/20 0.45
▸ KDR P35968 4/20 0.44
▸ EPHB4 P54760 2/20 0.44
▸ TEK Q02763 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL31535159 0.89 HDAC6 (0.57) HDAC6KDREPHB4TEK
SCHEMBL25350687 0.89 HDAC6 (0.57) HDAC6KDREPHB4TEK
SCHEMBL31535160 0.89 HDAC6 (0.57) HDAC6
SCHEMBL25349454 0.89 HDAC6 (0.57) HDAC6
SCHEMBL25349267 0.88 HDAC6 (0.56) HDAC6
SCHEMBL22557712 0.87 HDAC6 (0.70) HDAC6KDREPHB4TEK
SCHEMBL30409985 0.87 HDAC6 (0.56) HDAC6KDREPHB4TEK
SCHEMBL24215833 0.87 HDAC6 (0.56) HDAC6KDREPHB4TEK
SCHEMBL29402321 0.87 HDAC6 (0.70) HDAC6KDREPHB4TEK
SCHEMBL24216054 0.86 HDAC6 (0.67) HDAC6KDR

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
CN-116157398-B Oxadiazole-based selective histone deacetylase 6 inhibitors 意大发马克股份公司 2025-03-11 — — CN claimed
US-20220213084-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS FUNDACIÓN KERTOR (ES) 2022-07-07 — — 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-20220213084-A1 1,3,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC6, HDAC1, HDAC3 HDAC6 1/4885GPR55 4437/4885CD74 1531/4885

“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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