SCHEMBL32670494

SCHEMBL32670494

CC(C)(C)OC(=O)N[C@H]1CSc2cc(F)c(-c3noc(C(C)(C)S(C)(=O)=O)n3)cc2N(Cc2ccc(Oc3ccccc3)cc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 8/20 0.36
▸ HDAC8 Q9BY41 8/20 0.36
▸ HDAC6 Q9UBN7 8/20 0.36
▸ SRC P12931 3/20 0.35
▸ NPY1R P25929 1/20 0.33
▸ XIAP P98170 1/20 0.33
▸ RIPK1 Q13546 1/20 0.32
▸ HDAC5 Q9UQL6 5/20 0.32
▸ F7 P08709 4/20 0.32
▸ F3 P13726 4/20 0.32
▸ F2 P00734 2/20 0.32
▸ F10 P00742 1/20 0.31

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
SCHEMBL30830308 0.92 HDAC6 (0.37) HDAC1HDAC8HDAC6SRCHDAC5
SCHEMBL32670508 0.92 HDAC6 (0.38) HDAC1HDAC8HDAC6SRCHDAC5
SCHEMBL32670403 0.90 HDAC6 (0.35) HDAC1HDAC8HDAC6SRCXIAP
SCHEMBL30830344 0.88 HDAC6 (0.37) HDAC1HDAC8HDAC6SRCNPY1R
SCHEMBL31374881 0.88 HDAC1 (0.36) HDAC1HDAC8HDAC6NPY1RHDAC5
SCHEMBL29796828 0.84 HDAC6 (0.38) HDAC1HDAC8HDAC6RIPK1HDAC5
SCHEMBL26961865 0.84 HDAC6 (0.38) HDAC1HDAC8HDAC6RIPK1HDAC5
SCHEMBL26962075 0.84 HDAC6 (0.38) HDAC1HDAC8HDAC6SRCNPY1R
SCHEMBL29796770 0.83 HDAC6 (0.37) HDAC1HDAC8HDAC6SRCNPY1R
SCHEMBL26961676 0.83 HDAC6 (0.37) HDAC1HDAC8HDAC6SRCNPY1R

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-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2026-02-05 — — 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-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES SCN1B, SCN2B, SCN11A HDAC1 298/4885HDAC8 699/4885HDAC6 460/4885

“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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