SCHEMBL10045790

SCHEMBL10045790

CC(C)(C)[Si](OCC(NC(=O)OCc1ccccc1)C(=O)Cl)(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.49
CTSL P07711 4/20 0.49
CTSB P07858 3/20 0.49
CTSK P43235 5/20 0.47
ATM Q13315 1/20 0.46
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 1/20 0.46
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KYNU Q16719 1/20 0.45
SYK P43405 1/20 0.45
OPRK1 P41145 1/20 0.45
TACR1 P25103 2/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
PPARA Q07869 1/20 0.44
LMNA P02545 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL10045788 0.92 PPARA (0.51) CTSSCTSLCTSBCTSKATM
SCHEMBL23455702 0.92 PPARA (0.51) CTSSCTSLCTSBCTSKATM
SCHEMBL15924777 0.91 KYNU (0.53) CTSSCTSLCTSBCTSKATM
SCHEMBL15924778 0.91 KYNU (0.53) CTSSCTSLCTSBCTSKATM
SCHEMBL5724195 0.88 SYK (0.52) CTSSCTSLCTSBCTSKATM
SCHEMBL5724014 0.87 ATM (0.50) CTSSCTSLCTSBCTSKATM
SCHEMBL5724348 0.85 SYK (0.57) CTSSCTSLCTSBCTSKATM
SCHEMBL5724356 0.85 SYK (0.49) CTSSCTSLCTSBCTSKATM
SCHEMBL25401078 0.84 ATM (0.47) CTSSCTSLCTSBCTSKATM
SCHEMBL261847 0.84 SYK (0.48) CTSSCTSLCTSBCTSKATM

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-8093235-B2 Macrocyclic compounds which stabilize G-Quadruplex DNA and RNA RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-01-10 US disclosed
US-20090156627-A1 THERAPEUTIC COMPOUNDS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-06-18 US disclosed
WO-2007127173-A2 THERAPEUTIC COMPOUNDS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2007-11-08 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-20090156627-A1 THERAPEUTIC COMPOUNDS TOP2B, DDB1, RECQL CTSS 4044/4885CTSL 3581/4885CTSB 2815/4885

“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.