SCHEMBL4935936

SCHEMBL4935936

Cc1cc2nc(CCC(NC(=O)OC(C)(C)C)C(=O)OCc3ccccc3)n(Cc3cccc(F)c3)c2cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.45
CTSK P43235 2/20 0.45
GNRHR P30968 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SCN9A Q15858 4/20 0.39
CYP3A4 P08684 1/20 0.39
SCN10A Q9Y5Y9 1/20 0.39
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
ENPP2 Q13822 1/20 0.38
JAK2 O60674 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL4935924 1.00 CTSS (0.45) CTSSCTSKGNRHRMEN1KMT2A
SCHEMBL4935231 0.92 GNRHR (0.43) CTSSCTSKGNRHRSCN9ACYP3A4
SCHEMBL4935218 0.92 GNRHR (0.43) CTSSCTSKGNRHRSCN9ACYP3A4
SCHEMBL4938392 0.89 GNRHR (0.43) CTSSCTSKGNRHRSCN9ACYP3A4
SCHEMBL4938378 0.89 GNRHR (0.43) CTSSCTSKGNRHRSCN9ACYP3A4
SCHEMBL4934802 0.89 GNRHR (0.43) CTSSCTSKGNRHRSCN9ACYP3A4
SCHEMBL4932789 0.87 PPARA (0.44) CTSSCTSKSCN9APPARGSYK
SCHEMBL4928007 0.87 CTSK (0.41) CTSSCTSKSYKPPARA
SCHEMBL4928018 0.87 CTSK (0.41) CTSSCTSKSYKPPARA
SCHEMBL4929126 0.86 CTSS (0.44) CTSSCTSKGNRHRMEN1KMT2A

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 CTSS 1395/4885CTSK 322/4885GNRHR 4023/4885

“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.