SCHEMBL1011366

SCHEMBL1011366

NC(=O)c1cnc(N2CC3C(C2)C3N2CCCCC2)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 11/20 0.41
HDAC3 O15379 10/20 0.41
HDAC4 P56524 10/20 0.41
HDAC1 Q13547 10/20 0.41
HDAC7 Q8WUI4 10/20 0.41
HDAC2 Q92769 10/20 0.41
HDAC10 Q969S8 10/20 0.41
HDAC11 Q96DB2 10/20 0.41
HDAC8 Q9BY41 10/20 0.41
HDAC9 Q9UKV0 10/20 0.41
HDAC5 Q9UQL6 10/20 0.41
POLB P06746 1/20 0.36
ADRA1A P35348 2/20 0.36
HRH3 Q9Y5N1 3/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL1012083 0.86 POLB (0.50) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL8252640 0.84 HDAC3 (0.59) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL4790004 0.80 POLB (0.49) HDAC6POLBL3MBTL1MAPT
SCHEMBL1012360 0.80 HDAC3 (0.44) HDAC6HDAC3HDAC4HDAC1HDAC7
Hydrochloric Acid SCHEMBL1012595 0.79 HDAC3 (0.44) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL20917117 0.78 POLB (0.50) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL1014478 0.78 ADRA1A (0.44) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL30422887 0.74 HRH3 (0.47) HDAC1ADRA1AHRH3
SCHEMBL1010727 0.74 POLB (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL1011837 0.74 HDAC3 (0.51) HDAC6HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932246-B2 Histone deacetylase inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-04-26 US disclosed
EP-1881977-B1 HISTONE DEACETYLASE INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2011-01-05 EP disclosed
US-20100152155-A1 Histone Deacetylase Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2010-06-17 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-20100152155-A1 Histone Deacetylase Inhibitors HDAC1, HDAC2, HDAC11 HDAC6 10/4885HDAC3 6/4885HDAC4 7/4885

“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.