SCHEMBL2740740

SCHEMBL2740740

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.45
▸ CTSL P07711 2/20 0.43
▸ PPARG P37231 2/20 0.41
▸ KLK7 P49862 3/20 0.41
▸ KLK5 Q9Y337 3/20 0.41
▸ CTSS P25774 4/20 0.41
▸ SYK P43405 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ ACE P12821 1/20 0.40
▸ CTSK P43235 2/20 0.39
▸ CTSB P07858 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PTPN1 P18031 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
SCHEMBL2740739 0.92 CTSL (0.46) PPARACTSLKLK7KLK5CTSS
SCHEMBL2740593 0.87 CACNA1B (0.45) PPARACTSLKLK7KLK5CTSS
SCHEMBL12463941 0.78 NFKB1 (0.41) PPARACTSLPPARGCTSSATM
SCHEMBL12206456 0.76 KLK7 (0.46) PPARACTSLPPARGKLK7KLK5
SCHEMBL17685979 0.72 PPARA (0.50) PPARACTSLPPARGKLK7KLK5
SCHEMBL22687090 0.70 CTSL (0.57) PPARACTSLPPARGKLK7KLK5
SCHEMBL22687091 0.70 CTSL (0.57) PPARACTSLPPARGKLK7KLK5
SCHEMBL16096742 0.69 CTSL (0.52) PPARACTSLPPARGKLK7KLK5
SCHEMBL6359651 0.69 ALDH1A1 (0.56) PPARACTSLPPARGKLK7KLK5
SCHEMBL6359653 0.69 ALDH1A1 (0.56) PPARACTSLPPARGKLK7KLK5

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 3 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

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 PPARA 2013/4885CTSL 1280/4885PPARG 2325/4885

“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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