SCHEMBL4932789

SCHEMBL4932789

Cc1cc2nc(CCC(NC(=O)OC(C)(C)C)C(=O)OCc3ccccc3)n(CC(C)(C)C)c2cc1C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.44
HDAC1 Q13547 1/20 0.42
CTSS P25774 2/20 0.42
CTSK P43235 2/20 0.42
PPARG P37231 2/20 0.41
ACE P12821 1/20 0.40
TACR1 P25103 1/20 0.40
KLK7 P49862 3/20 0.39
SCN9A Q15858 1/20 0.39
KLK5 Q9Y337 2/20 0.39
MAPT P10636 1/20 0.39
SYK P43405 1/20 0.38
PTPN1 P18031 1/20 0.38

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
SCHEMBL4928018 0.91 CTSK (0.41) PPARAHDAC1CTSSCTSKTACR1
SCHEMBL4928007 0.91 CTSK (0.41) PPARAHDAC1CTSSCTSKTACR1
SCHEMBL4928025 0.89 CTSK (0.43) CTSSCTSKKLK7KLK5MAPT
SCHEMBL4934802 0.88 GNRHR (0.43) PPARACTSSCTSKPPARGACE
SCHEMBL4935936 0.87 CTSS (0.45) PPARACTSSCTSKPPARGSCN9A
SCHEMBL4935924 0.87 CTSS (0.45) PPARACTSSCTSKPPARGSCN9A
SCHEMBL4936383 0.87 CTSS (0.42) PPARACTSSCTSKPPARGACE
SCHEMBL4936373 0.87 CTSS (0.42) PPARACTSSCTSKPPARGACE
SCHEMBL4938304 0.87 CTSS (0.42) PPARACTSSCTSKPPARGACE
SCHEMBL4938378 0.87 GNRHR (0.43) PPARACTSSCTSKPPARGSCN9A

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 PPARA 2546/4885HDAC1 2/4885CTSS 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.