SCHEMBL4933962

SCHEMBL4933962

Cn1c(CC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)nc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.49
ALDH1A1 P00352 1/20 0.47
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
MAPT P10636 2/20 0.46
PPARA Q07869 1/20 0.45
RECQL P46063 1/20 0.44
SYK P43405 1/20 0.42
MAOA P21397 1/20 0.42
CYP3A4 P08684 1/20 0.42
SCN9A Q15858 1/20 0.42
TSHR P16473 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
SCHEMBL4933982 1.00 HDAC6 (0.49) HDAC6ALDH1A1CTSSCTSKMAPT
SCHEMBL4935261 0.89 MEN1 (0.47) CTSSCTSKMAPTSYKMAOA
SCHEMBL4935274 0.89 MEN1 (0.47) CTSSCTSKMAPTSYKMAOA
SCHEMBL4934959 0.89 POLB (0.50) ALDH1A1CTSSCTSKMAPTPPARA
SCHEMBL4934968 0.89 POLB (0.50) ALDH1A1CTSSCTSKMAPTPPARA
SCHEMBL4937221 0.88 HDAC6 (0.55) HDAC6ALDH1A1CTSSCTSKMAPT
SCHEMBL4937239 0.88 HDAC6 (0.55) HDAC6ALDH1A1CTSSCTSKMAPT
SCHEMBL4930469 0.87 TP53 (0.49) CTSKRECQL
SCHEMBL4930481 0.87 TP53 (0.49) CTSKRECQL
SCHEMBL4926801 0.86 HDAC6 (0.47) HDAC6ALDH1A1MAPTRECQLMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative KUREHA CORPORATION (JP) 2008-06-05 US disclosed
EP-1707560-A1 HYDROXAMIC ACID DERIVATIVE AND AGE GENERATION INHIBITOR CONTAINING THE DERIVATIVE Kureha Corporation (JP) 2006-10-04 EP 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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative HDAC5, HDAC1, HDAC9 HDAC6 10/4885ALDH1A1 1829/4885CTSS 1395/4885

“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.