SCHEMBL18356972

SCHEMBL18356972

CC(C)(C)N1C[C@@H]2C[C@H]1CN2c1ccc(C(=O)NO)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 8/20 0.43
HDAC6 Q9UBN7 10/20 0.42
HDAC8 Q9BY41 7/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
RECQL P46063 1/20 0.36
ADAM17 P78536 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL12142417 0.90 HDAC2 (0.38) HDAC1HDAC6HDAC8HDAC2
SCHEMBL12142421 0.90 HDAC2 (0.38) HDAC1HDAC6HDAC8HDAC2
SCHEMBL1365143 0.83 HDAC6 (0.59) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL15832592 0.83 HDAC6 (0.46) HDAC1HDAC6HDAC8HDAC2KDM4E
SCHEMBL17415644 0.83 HDAC6 (0.59) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL16302065 0.83 HDAC6 (0.46) HDAC1HDAC6HDAC8HDAC2KDM4E
SCHEMBL12142422 0.82 HDAC1 (0.49) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL18356434 0.80 HDAC1 (0.41) HDAC1HDAC6HDAC8HDAC2HDAC3
SCHEMBL16330247 0.79 DRD2 (0.45) HDAC1HDAC6HDAC8HDAC2
SCHEMBL15832594 0.79 DRD2 (0.45) HDAC1HDAC6HDAC8HDAC2

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-20170000749-A1 Methods for Treating Cognitive Disorders Using Inhibitors of Histone Deacetylase FMR LLC 2017-01-05 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-20170000749-A1 Methods for Treating Cognitive Disorders Using Inhibitors of Histone Deacetylase HDAC5, KAT2A, HDAC1 HDAC1 3/4885HDAC6 11/4885HDAC8 8/4885

“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.