SCHEMBL1931064

SCHEMBL1931064

C[Si](O)(c1ccccc1)c1ccc(C(=O)Nc2cc(-c3ccccc3)ccc2N(Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 0.54
HDAC3 O15379 2/20 0.52
HDAC2 Q92769 2/20 0.52

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
SCHEMBL1932098 0.78 HDAC2 (0.71) HDAC1HDAC3HDAC2
SCHEMBL12535796 0.77 HDAC1 (0.56) HDAC1HDAC3HDAC2
SCHEMBL1931065 0.76 HDAC1 (0.52) HDAC1HDAC3HDAC2
SCHEMBL3771409 0.73 HDAC1 (0.76) HDAC1HDAC3HDAC2
SCHEMBL3638201 0.70 HDAC1 (1.00) HDAC1HDAC3HDAC2
SCHEMBL1930616 0.69 HDAC1 (0.64) HDAC1HDAC3HDAC2
SCHEMBL1931108 0.69 HDAC1 (0.53) HDAC1HDAC3HDAC2
SCHEMBL2209584 0.69 HDAC1 (0.53) HDAC1HDAC3HDAC2
SCHEMBL4720338 0.69 KCNQ3 (0.47) HDAC1HDAC3HDAC2
SCHEMBL18653512 0.68 HDAC1 (1.00) HDAC1HDAC3HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110130361-A1 SILICON DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS GRIMM JONATHAN 2011-06-02 US disclosed
EP-2185554-A1 SILICON DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2010-05-19 EP disclosed
WO-2009020589-A1 SILICON DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS MERCK & CO., INC. (US) 2009-02-12 WO 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-20110130361-A1 SILICON DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC5, HDAC2 HDAC1 1/4885HDAC3 10/4885HDAC2 3/4885

“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.