SCHEMBL25267677

SCHEMBL25267677

CC(=O)Nc1cccc(-c2cn(Cc3c(F)cc(-c4nnc(C(F)F)o4)cc3F)nn2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UCHL5 Q9Y5K5 2/20 0.51
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HDAC6 Q9UBN7 7/20 0.46
▸ HDAC1 Q13547 5/20 0.44
▸ HDAC3 O15379 4/20 0.44
▸ HDAC2 Q92769 3/20 0.44
▸ HDAC10 Q969S8 3/20 0.44
▸ HDAC8 Q9BY41 3/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ ATR Q13535 1/20 0.43
▸ KDR P35968 2/20 0.41
▸ TEK Q02763 1/20 0.41
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ PRSS12 P56730 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39

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
SCHEMBL30424907 1.00 UCHL5 (0.51) UCHL5NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL26226636 0.92 CYP3A4 (0.52) UCHL5NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL30409726 0.90 UCHL5 (0.49) UCHL5NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL24215838 0.90 UCHL5 (0.49) UCHL5NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL25262079 0.90 HDAC6 (0.47) UCHL5NPC1SMN1; SMN2TSHRHDAC6
SCHEMBL25254596 0.88 KDM4E (0.45) UCHL5HDAC6HDAC1HDAC3HDAC2
SCHEMBL30424957 0.88 KDM4E (0.45) UCHL5HDAC6HDAC1HDAC3HDAC2
SCHEMBL29022608 0.88 HDAC6 (0.42) UCHL5HDAC6HDAC1HDAC3HDAC2
SCHEMBL25252848 0.88 HDAC6 (0.46) UCHL5HDAC6HDAC1HDAC3HDAC2
SCHEMBL30425231 0.88 HDAC6 (0.46) UCHL5HDAC6HDAC1HDAC3HDAC2

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 5 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 claimed
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 claimed
US-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-09-14 — — US disclosed
US-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-09-14 — — US disclosed
US-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-09-14 — — 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-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS HDAC6, HDAC1, HDAC3 UCHL5 923/4885NPC1 3167/4885RAB9A 3395/4885

“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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