SCHEMBL7364347

SCHEMBL7364347

CNC(=O)C(=O)CCCCCCNC(=O)c1csc(-c2ccccc2)n1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 10/20 0.58
HDAC2 Q92769 5/20 0.58
HDAC3 O15379 4/20 0.56
HPGDS O60760 2/20 0.55
HPGD P15428 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HDAC6 Q9UBN7 3/20 0.52
HDAC8 Q9BY41 1/20 0.52
ACKR3 P25106 2/20 0.52
TDP1 Q9NUW8 1/20 0.50
TLR7 Q9NYK1 1/20 0.47

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
SCHEMBL20170935 0.84 HPGDS (0.61) HDAC1HDAC3HPGDSHPGDCYP1A2
SCHEMBL3547707 0.84 HPGDS (0.61) HDAC1HDAC3HPGDSHPGDCYP1A2
SCHEMBL7366253 0.80 HDAC1 (0.64) HDAC1HDAC2HDAC3HDAC6HDAC8
SCHEMBL7365399 0.80 HDAC1 (0.61) HDAC1HDAC2HDAC3HDAC6HDAC8
SCHEMBL3436271 0.79 HPGD (0.66) HDAC1HPGDSHPGDCYP1A2CYP3A4
SCHEMBL27966332 0.79 HPGD (0.66) HDAC1HDAC3HPGDSHPGDCYP1A2
SCHEMBL13407997 0.77 HPGD (0.77) HDAC1HPGDSHPGDCYP1A2CYP3A4
SCHEMBL26453259 0.77 HPGD (0.63) HDAC1HDAC3HPGDSHPGDCYP1A2
SCHEMBL7368674 0.77 HDAC1 (0.80) HDAC1HDAC2HDAC3HDAC6HDAC8
SCHEMBL12789158 0.76 HPGD (0.69) HDAC1HDAC2HPGDSHPGDCYP1A2

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-20020177594-A1 Inhibitors of histone deacetylase ABBOTT LABORATORIES 2002-11-28 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-20020177594-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC2 4/4885HDAC3 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.