SCHEMBL4453208

SCHEMBL4453208

COC(=O)C[C@@H](O)c1cc(F)cc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RAB9A P51151 1/20 0.36
HSP90AB1 P08238 1/20 0.34
LMNA P02545 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
SCHEMBL4467344 1.00 MAPT (0.44) MAPTALDH1A1HTTCES2CES1
SCHEMBL4453212 1.00 MAPT (0.44) MAPTALDH1A1HTTCES2CES1
SCHEMBL8770903 0.83 L3MBTL1 (0.49) MAPTALDH1A1HTTCES2CES1
SCHEMBL8770949 0.83 CES2 (0.40) MAPTALDH1A1HTTCES2CES1
SCHEMBL8770971 0.82 HTT (0.59) MAPTALDH1A1HTTRAB9ALMNA
SCHEMBL8770924 0.81 CES2 (0.39) CES2CES1
SCHEMBL8771183 0.79 L3MBTL1 (0.50) ALDH1A1L3MBTL1
SCHEMBL8771019 0.79 KCNA5 (0.38) MAPTALDH1A1HTTL3MBTL1RAB9A
SCHEMBL8770904 0.79 L3MBTL1 (0.46) MAPTALDH1A1L3MBTL1RAB9ALMNA
SCHEMBL18640896 0.78 ALDH1A1 (0.41) MAPTALDH1A1HTTCES2CES1

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-20090118223-A1 Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives MERCK SHARP & DOHME CORP. 2009-05-07 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-20090118223-A1 Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives MTAP, NT5C3B, NSUN2 MAPT 4160/4885ALDH1A1 1977/4885HTT 4818/4885

“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.