SCHEMBL4935326

SCHEMBL4935326

CCCN(C(=O)OC(C)(C)C)[C@@H](CCc1nc2ccccc2n1C)C(=O)NOCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.42
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
TSHR P16473 2/20 0.40
MAPT P10636 1/20 0.40
NTRK1 P04629 4/20 0.38
NTRK2 Q16620 3/20 0.38
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL4935333 1.00 HDAC6 (0.42) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4933262 0.94 HDAC6 (0.40) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4933259 0.94 HDAC6 (0.40) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4939039 0.92 GAA (0.43) MAPTGAASMN1; SMN2NPC1
SCHEMBL4939046 0.92 GAA (0.43) MAPTGAASMN1; SMN2NPC1
SCHEMBL4926824 0.88 HDAC6 (0.45) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4926816 0.88 HDAC6 (0.45) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4933087 0.86 HDAC6 (0.50) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4933079 0.86 HDAC6 (0.50) HDAC6ALDH1A1RECQLTSHRMAPT
SCHEMBL4935045 0.86 ALDH1A1 (0.40) HDAC6ALDH1A1RECQLTSHRMAPT

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 1829/4885RECQL 3225/4885

“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.