SCHEMBL5565382

SCHEMBL5565382

O=C(/C=C/c1cccc(-c2nc3ccccc3n2CCN2CCOCC2)c1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 1.00
HDAC8 Q9BY41 20/20 1.00
HDAC6 Q9UBN7 19/20 1.00

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
SCHEMBL5565384 1.00 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL8250351 0.92 HDAC1 (0.85) HDAC1HDAC8HDAC6
SCHEMBL5565484 0.92 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5565481 0.92 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL6515459 0.88 HDAC1 (0.79) HDAC1HDAC8HDAC6
SCHEMBL6515455 0.88 HDAC1 (0.79) HDAC1HDAC8HDAC6
SCHEMBL6508936 0.86 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL6508929 0.86 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL6498440 0.85 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL6498435 0.85 HDAC1 (1.00) HDAC1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169801-B2 Histone deacetylase inhibitors TAKEDA SAN DIEGO, INC. (US) 2007-01-30 US claimed
US-20040266769-A1 Histone deacetylase inhibitors SYRRX, INC. 2004-12-30 US claimed
US-7169801-B2 Histone deacetylase inhibitors TAKEDA SAN DIEGO, INC. (US) 2007-01-30 US disclosed
US-20040266769-A1 Histone deacetylase inhibitors SYRRX, INC. 2004-12-30 US disclosed
WO-2004082638-A2 HISTONE DEACETYLASE INHIBITORS SYRRX, INC. (US) 2004-09-30 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-20040266769-A1 Histone deacetylase inhibitors HDAC1, HDAC11, HDAC10 HDAC1 1/4885HDAC8 10/4885HDAC6 11/4885

“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.