SCHEMBL6692785

SCHEMBL6692785

CC(C)[Si](O[C@@H](CS(=O)(=O)Cc1ccccc1OC(F)F)C(=O)O)(C(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.36
PPARA Q07869 3/20 0.36
ALKBH1 Q13686 1/20 0.35
HPGD P15428 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAP3K7 O43318 2/20 0.33
TAB1 Q15750 2/20 0.33
TNF P01375 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
DAGLA Q9Y4D2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL6692787 1.00 PPARG (0.36) PPARGPPARAALKBH1HPGDKMT2A
SCHEMBL6629902 0.80 HPGD (0.53) PPARGPPARAHPGDKMT2AALDH1A1
SCHEMBL6629895 0.80 HPGD (0.53) PPARGPPARAHPGDKMT2AALDH1A1
SCHEMBL6630252 0.78 HPGD (0.42) PPARGPPARAALKBH1HPGDKMT2A
SCHEMBL6630248 0.78 HPGD (0.42) PPARGPPARAALKBH1HPGDKMT2A
SCHEMBL5696557 0.73 TNF (0.43) HPGDKMT2AMEN1ALDH1A1TNF
SCHEMBL6630648 0.72 KMT2A (0.65) ALKBH1HPGDKMT2AMEN1ALDH1A1
SCHEMBL5418267 0.71 CTSS (0.43) KMT2A
SCHEMBL6633834 0.71 CTSS (0.45) PPARGPPARAALDH1A1
SCHEMBL6633837 0.71 CTSS (0.45) PPARGPPARAALDH1A1

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
US-20040142999-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2004-07-22 US disclosed
EP-1397340-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-03-17 EP disclosed
WO-2002098850-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-12-12 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-20040142999-A1 Novel compounds and compositions as cathepsin inhibitors CTSS, CTSB, CTSE PPARG 1625/4885PPARA 2585/4885ALKBH1 4585/4885

“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.