SCHEMBL4928007

SCHEMBL4928007

CCCn1c(CC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)nc2cc(C)c(C)cc21

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.41
CTSS P25774 2/20 0.41
HDAC1 Q13547 1/20 0.40
SYK P43405 1/20 0.40
PPARA Q07869 1/20 0.40
P2RX3 P56373 1/20 0.40
TACR1 P25103 1/20 0.39
KLK7 P49862 2/20 0.39
KLK5 Q9Y337 1/20 0.39
MAPT P10636 1/20 0.38
MAOA P21397 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 1.00 CTSK (0.41) CTSKCTSSHDAC1SYKPPARA
SCHEMBL4928025 0.94 CTSK (0.43) CTSKCTSSKLK7KLK5MAPT
SCHEMBL4933987 0.91 AGTR1 (0.41) CTSKCTSSHDAC1SYKPPARA
SCHEMBL4933996 0.91 AGTR1 (0.41) CTSKCTSSHDAC1SYKPPARA
SCHEMBL4932789 0.91 PPARA (0.44) CTSKCTSSHDAC1SYKPPARA
SCHEMBL4935261 0.90 MEN1 (0.47) CTSKCTSSSYKMAPTMAOA
SCHEMBL4935274 0.90 MEN1 (0.47) CTSKCTSSSYKMAPTMAOA
SCHEMBL4934802 0.87 GNRHR (0.43) CTSKCTSSPPARAP2RX3TACR1
SCHEMBL4935924 0.87 CTSS (0.45) CTSKCTSSSYKPPARA
SCHEMBL4935936 0.87 CTSS (0.45) CTSKCTSSSYKPPARA

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 CTSK 322/4885CTSS 1395/4885HDAC1 2/4885

“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.