SCHEMBL15933384

SCHEMBL15933384

Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(CNC(=O)c2cc3ccccc3o2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 6/20 1.00
HDAC1 Q13547 17/20 0.76

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
SCHEMBL15685092 0.92 HDAC2 (0.85) HDAC2HDAC1
SCHEMBL15653742 0.88 HDAC2 (0.79) HDAC2HDAC1
SCHEMBL1067561 0.88 HDAC2 (0.77) HDAC2HDAC1
SCHEMBL15685093 0.87 HDAC2 (0.77) HDAC2HDAC1
SCHEMBL3646210 0.87 HDAC1 (1.00) HDAC2HDAC1
SCHEMBL3645080 0.84 HDAC1 (0.86) HDAC2HDAC1
SCHEMBL3642404 0.83 HDAC1 (1.00) HDAC2HDAC1
SCHEMBL15933362 0.83 HDAC2 (1.00) HDAC2HDAC1
SCHEMBL15933369 0.82 HDAC2 (1.00) HDAC2HDAC1
SCHEMBL3640132 0.81 HDAC1 (1.00) HDAC2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040727-B2 Histone deacetylase inhibitor of benzamides and use thereof SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-05-26 US disclosed
US-20140221431-A1 NOVEL HISTONE DEACETYLASE INHIBITOR OF BENZAMIDES AND USE THEREOF SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2014-08-07 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-20140221431-A1 NOVEL HISTONE DEACETYLASE INHIBITOR OF BENZAMIDES AND USE THEREOF HDAC2, HDAC1, HDAC5 HDAC2 1/4885HDAC1 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.