SCHEMBL2176326

SCHEMBL2176326

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
PPARG P37231 4/20 0.36
PPARA Q07869 3/20 0.36
RIPK1 Q13546 1/20 0.35
SCD5 Q86SK9 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GRM5 P41594 1/20 0.35
MAOB P27338 1/20 0.34
JAK2 O60674 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL2175743 0.85 SLC1A1 (0.37) SLC1A1CTSSCTSKPPARGPPARA
SCHEMBL2078006 0.84 PTGES (0.33)
SCHEMBL2078009 0.84 PTGES (0.33)
SCHEMBL1797387 0.80 CYP3A4 (0.44) ALDH1A1HPGDATMNPSR1
SCHEMBL3577732 0.79 CTSS (0.42) SLC1A1CTSSCTSKPPARGPPARA
SCHEMBL676632 0.79 SLC1A1 (0.46) SLC1A1CTSSCTSKPPARGPPARA
SCHEMBL2769284 0.75 ALKBH1 (0.33) MEN1KMT2AALDH1A1NPSR1
SCHEMBL4993913 0.74 GAA (0.35) ALDH1A1NPSR1
SCHEMBL925423 0.72 MEN1 (0.35) CTSKMEN1KMT2AALDH1A1HPGD
SCHEMBL925425 0.72 MEN1 (0.35) CTSKMEN1KMT2AALDH1A1HPGD

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-7973047-B2 Beta-Secretase modulators and methods of use AMGEN INC. (US) 2011-07-05 US disclosed
US-20100222338-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. 2010-09-02 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-20100222338-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP SLC1A1 3740/4885CTSS 43/4885CTSK 79/4885

“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.