SCHEMBL29640425

SCHEMBL29640425

O=C(NO)c1ccc(Cn2nnc(Cc3ccccn3)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 1.00
HDAC1 Q13547 6/20 0.66
HDAC2 Q92769 3/20 0.66
HDAC8 Q9BY41 3/20 0.66
HDAC3 O15379 2/20 0.66
HDAC4 P56524 2/20 0.66
HDAC7 Q8WUI4 2/20 0.66
HDAC10 Q969S8 2/20 0.66
HDAC11 Q96DB2 2/20 0.66
HDAC9 Q9UKV0 2/20 0.66
HDAC5 Q9UQL6 2/20 0.66

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
SCHEMBL23317003 1.00 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL20534883 0.85 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL29640407 0.83 HDAC6 (0.71) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL23316990 0.83 HDAC6 (0.71) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL30368751 0.81 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL20534798 0.81 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL20535624 0.80 HDAC6 (0.86) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL20534984 0.80 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC8HDAC3
Trifluoroacetic Acid SCHEMBL20534780 0.78 HDAC6 (0.64) HDAC6HDAC1HDAC2HDAC8HDAC3
SCHEMBL23316980 0.78 HDAC6 (0.64) HDAC6HDAC1HDAC2HDAC8HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110546140-B Selective HDAC6 inhibitors 意大发马克股份公司 2023-05-16 CN claimed
EP-3562810-B1 BENZHYDROXAMIC ACID DERIVATIVES AS SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-05-03 EP claimed
US-11351178-B2 Selective HDAC6 inhibitors ITALFARMACO SPA (IT) 2022-06-07 US claimed
CN-110546140-B Selective HDAC6 inhibitors 意大发马克股份公司 2023-05-16 CN disclosed
EP-3562810-B1 BENZHYDROXAMIC ACID DERIVATIVES AS SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-05-03 EP disclosed
US-11351178-B2 Selective HDAC6 inhibitors ITALFARMACO SPA (IT) 2022-06-07 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-11351178-B2 Selective HDAC6 inhibitors HDAC6, HDAC1, HDAC3 HDAC6 1/4885HDAC1 2/4885HDAC2 5/4885

“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.