SCHEMBL3572220

SCHEMBL3572220

CC(C)(C)[Si](C)(C)O[C@H](C=O)[C@H](Cc1cccc(F)c1)NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
JAK2 O60674 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC1A1 P43005 2/20 0.38
GRM5 P41594 2/20 0.37
PPARG P37231 3/20 0.37
BACE1 P56817 3/20 0.37
PPARA Q07869 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36

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
SCHEMBL2178555 0.92 BACE1 (0.45) CTSSCTSKJAK2ALDH1A1TP53
SCHEMBL924795 0.88 ATM (0.39) CTSKATMBACE1
SCHEMBL924796 0.88 ATM (0.39) CTSKATMBACE1
SCHEMBL3577732 0.84 CTSS (0.42) CTSSCTSKJAK2ALDH1A1TP53
SCHEMBL4352424 0.84 KDM4E (0.35) ALDH1A1BACE1TSHR
SCHEMBL2175747 0.83 CTSS (0.42) CTSSCTSKJAK2ALDH1A1TP53
SCHEMBL4356102 0.83 PTGES (0.34) BACE1
SCHEMBL4356095 0.83 PTGES (0.34) BACE1
SCHEMBL2176328 0.82 CTSS (0.41) CTSSCTSKJAK2ALDH1A1TP53
SCHEMBL2175743 0.80 SLC1A1 (0.37) CTSSCTSKJAK2ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745484-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2010-06-29 US disclosed
US-20070185144-A1 Beta-secretase modulators and methods of use AMGEN INC. (US) 2007-08-09 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-20070185144-A1 Beta-secretase modulators and methods of use BACE1, BACE2, APP CTSS 43/4885CTSK 79/4885JAK2 4790/4885

“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.