SCHEMBL13643256

SCHEMBL13643256

C[C@@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.44
CTSS P25774 5/20 0.43
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
PPARA Q07869 5/20 0.41
PPARG P37231 4/20 0.41
ATM Q13315 2/20 0.41
ACE P12821 1/20 0.41
PPARD Q03181 2/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL31306238 0.88 PPARA (0.49) CTSKCTSSCTSLCTSBPPARA
SCHEMBL31228403 0.88 PPARA (0.49) CTSKCTSSCTSLCTSBPPARA
SCHEMBL28408779 0.86 ATM (0.43) CTSKCTSSCTSLCTSBPPARA
SCHEMBL19300689 0.86 ATM (0.43) CTSKCTSSCTSLCTSBPPARA
SCHEMBL31526993 0.86 KLK5 (0.46) CTSKCTSSCTSLCTSBPPARA
SCHEMBL30096601 0.86 ATM (0.45) CTSKCTSSCTSLCTSBPPARA
SCHEMBL28523692 0.86 ATM (0.45) CTSKCTSSCTSLCTSBPPARA
SCHEMBL21808744 0.85 CTSK (0.48) CTSKCTSSCTSLCTSBATM
SCHEMBL21808745 0.85 CTSK (0.48) CTSKCTSSCTSLCTSBATM
SCHEMBL2617388 0.85 ATM (0.44) CTSKCTSSCTSLCTSBPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120283287-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2012-11-08 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-20120283287-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS KIF5B, KIF2C, PLK1 CTSK 1842/4885CTSS 1766/4885CTSL 3872/4885

“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.