SCHEMBL2740739

SCHEMBL2740739

CC(C)(C)OC(=O)N[C@H](C(=O)OCc1ccccc1)C1C=CC(OCc2ccccc2)=CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.46
▸ SYK P43405 1/20 0.44
▸ KLK7 P49862 4/20 0.43
▸ KLK5 Q9Y337 3/20 0.43
▸ MAPT P10636 2/20 0.42
▸ PPARA Q07869 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ NTSR1 P30989 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ ATM Q13315 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL2740740 0.92 PPARA (0.45) CTSLSYKKLK7KLK5MAPT
SCHEMBL2740593 0.89 CACNA1B (0.45) CTSLSYKKLK7KLK5MAPT
SCHEMBL22687091 0.78 CTSL (0.57) CTSLSYKKLK7KLK5MAPT
SCHEMBL22687090 0.78 CTSL (0.57) CTSLSYKKLK7KLK5MAPT
SCHEMBL12206456 0.76 KLK7 (0.46) CTSLKLK7KLK5PPARACTSS
SCHEMBL22433332 0.76 KLK7 (0.54) CTSLSYKKLK7KLK5MAPT
SCHEMBL22433331 0.76 KLK7 (0.54) CTSLSYKKLK7KLK5MAPT
SCHEMBL8234039 0.75 CTSL (0.59) CTSLSYKKLK7KLK5PPARA
SCHEMBL28290407 0.72 SYK (0.57) CTSLSYKKLK7KLK5MAPT
SCHEMBL23837230 0.71 CTSS (0.60) CTSLSYKKLK7KLK5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877366-B1 HYDROXAMIC ACID DERVICATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2012-01-04 — — EP disclosed
US-7973181-B2 Hydroxamic acid derivatives as inhibitors of HDAC enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2011-07-05 — — US disclosed
US-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2009-12-03 — — US disclosed
WO-2006117548-A1 HYDROXAMIC ACID DERVICATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2006-11-09 — — WO 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-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY HDAC1, HDAC3, HAT1 CTSL 1280/4885SYK 3048/4885KLK7 4697/4885

“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.

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