SCHEMBL24294041

SCHEMBL24294041

CN(Cc1ccc(/C=C/C(=O)NO)cc1)CC(C)(C)C

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 8/20 0.69
▸ HDAC6 Q9UBN7 8/20 0.69
▸ HDAC1 Q13547 11/20 0.58
▸ HDAC8 Q9BY41 9/20 0.58
▸ HDAC2 Q92769 8/20 0.58
▸ HDAC4 P56524 3/20 0.58
▸ HDAC10 Q969S8 3/20 0.58
▸ HDAC5 Q9UQL6 3/20 0.58
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ HDAC11 Q96DB2 2/20 0.49
▸ HDAC7 Q8WUI4 1/20 0.49
▸ HDAC9 Q9UKV0 1/20 0.49
▸ MEF2D Q14814 1/20 0.48
▸ BCHE P06276 1/20 0.48
▸ ACHE P22303 1/20 0.48
▸ ADAM17 P78536 1/20 0.47

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
SCHEMBL23054865 0.84 HDAC3 (0.75) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL12150981 0.82 HDAC6 (1.00) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL12592142 0.82 HDAC3 (0.71) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL13949775 0.76 HDAC3 (0.65) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL17483891 0.76 HDAC1 (0.71) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL8256427 0.74 HDAC3 (0.68) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL19666006 0.74 HDAC6 (1.00) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL19678427 0.74 HDAC6 (1.00) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL16653780 0.74 HDAC6 (1.00) HDAC3HDAC6HDAC1HDAC8HDAC2
SCHEMBL16653782 0.74 HDAC6 (1.00) HDAC3HDAC6HDAC1HDAC8HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220089616-A1 CARBORANE-BASED HISTONE DEACETYLASE (HDAC) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-03-24 — — 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-20220089616-A1 CARBORANE-BASED HISTONE DEACETYLASE (HDAC) INHIBITORS HDAC5, HDAC1, HDAC7 HDAC3 9/4885HDAC6 10/4885HDAC1 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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