SCHEMBL2980640

SCHEMBL2980640

CC(C)(C)c1ccc2[nH]c3c(c2c1)CN(c1ncc(C(=O)NO)cn1)CC3

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.52
HDAC6 Q9UBN7 5/20 0.52
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
TRPV1 Q8NER1 3/20 0.44
BAZ2B Q9UIF8 8/20 0.43
CFTR P13569 1/20 0.41
HDAC2 Q92769 1/20 0.41

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
SCHEMBL2978845 0.90 HDAC1 (0.52) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2965905 0.87 HDAC1 (0.65) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2979006 0.86 BAZ2B (0.55) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2975642 0.86 HDAC1 (0.49) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2981233 0.85 HDAC6 (0.51) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2980392 0.85 BAZ2B (0.54) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2978179 0.85 HDAC1 (0.65) HDAC1HDAC6BAZ2BCFTR
SCHEMBL2963961 0.85 BAZ2B (0.54) HDAC1HDAC6POLBGAAHDAC8
SCHEMBL2975835 0.85 BAZ2B (0.58) HDAC1HDAC6HDAC8BAZ2BCFTR
SCHEMBL2971775 0.84 HDAC1 (0.48) HDAC1HDAC6POLBGAAHDAC8

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-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US claimed
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20060199829-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. 2006-09-07 US disclosed
WO-2006088949-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF HISTONE DEACETYLASE MIIKANA THERAPEUTICS, INC. (US) 2006-08-24 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-20060199829-A1 Inhibitors of histone deacetylase HDAC1, HDAC2, HDAC11 HDAC1 1/4885HDAC6 11/4885POLB 480/4885

“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.