SCHEMBL29507

SCHEMBL29507

Cc1n[nH]c(C)c1C(C)[C@@H]1C[C@@H](F)CN1Cc1ccc(C=CC(=O)NO)cn1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 0.35
HDAC8 Q9BY41 11/20 0.35
HDAC3 O15379 10/20 0.35
HDAC4 P56524 10/20 0.35
HDAC7 Q8WUI4 10/20 0.35
HDAC2 Q92769 10/20 0.35
HDAC10 Q969S8 10/20 0.35
HDAC11 Q96DB2 10/20 0.35
HDAC6 Q9UBN7 10/20 0.35
HDAC9 Q9UKV0 10/20 0.35
HDAC5 Q9UQL6 10/20 0.35
KCNH2 Q12809 4/20 0.34

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
SCHEMBL29506 1.00 HDAC1 (0.35) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2732664 0.81 HDAC1 (0.41) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2732662 0.81 HDAC1 (0.41) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL30077 0.75 HDAC1 (0.48) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL30078 0.75 HDAC1 (0.48) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL6898783 0.73 HDAC1 (0.37) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL29508 0.72 LMNA (0.37) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL29505 0.72 LMNA (0.37) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2731322 0.71 HDAC1 (0.41) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL2731321 0.71 HDAC1 (0.41) HDAC1HDAC8HDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231373-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES NOVARTIS AG (CH) 2013-09-05 US claimed
EP-2609078-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES Novartis AG (CH) 2013-07-03 EP claimed
WO-2012025164-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES NOVARTIS AG (CH) 2012-03-01 WO claimed
US-20110060009-A1 Hydroxamate-Based Inhibitors of Deacetylases NOVARTIS AG 2011-03-10 US claimed
US-20130231373-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES NOVARTIS AG (CH) 2013-09-05 US disclosed
US-20110060009-A1 Hydroxamate-Based Inhibitors of Deacetylases NOVARTIS AG 2011-03-10 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 (2 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-20130231373-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC8 8/4885HDAC3 3/4885
US-20110060009-A1 Hydroxamate-Based Inhibitors of Deacetylases HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC8 8/4885HDAC3 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.