SCHEMBL4953147

SCHEMBL4953147

CC(C)CN(O)[C@H]1[C@H](F)[C@@H](n2cc(F)c(=O)[nH]c2=O)O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 2/20 0.36
P2RY14 Q15391 2/20 0.36
NT5E P21589 1/20 0.36
HSP90AA1 P07900 1/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.35
PMP22 Q01453 1/20 0.35
HBB P68871 1/20 0.35
TYMS P04818 1/20 0.35
SMYD2 Q9NRG4 2/20 0.33
P2RY2 P41231 1/20 0.31

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
SCHEMBL5637213 1.00 P2RY6 (0.36) P2RY6P2RY14NT5EHSP90AA1LMNA
SCHEMBL5637956 0.90 P2RY6 (0.39) P2RY6P2RY14NT5EHSP90AA1LMNA
SCHEMBL4949133 0.88 P2RY6 (0.38) P2RY6P2RY14P2RY2
SCHEMBL7811414 0.80 P2RY6 (0.54) P2RY6P2RY14NT5ELMNASMN1; SMN2
SCHEMBL4952184 0.80 LMNA (0.47) P2RY6P2RY14NT5ELMNASMN1; SMN2
SCHEMBL4952199 0.80 LMNA (0.47) P2RY6P2RY14NT5ELMNASMN1; SMN2
SCHEMBL4955997 0.80 LMNA (0.47) P2RY6P2RY14NT5ELMNASMN1; SMN2
SCHEMBL4953569 0.77 P2RY1 (0.42) P2RY6P2RY14P2RY2
SCHEMBL10647159 0.77 DNPH1 (0.41) NT5E
SCHEMBL10645210 0.77 DNPH1 (0.41) NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1284741-B1 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF VIRAL INFECTIONS PHARMASSET INC (US) 2008-11-19 EP disclosed
EP-1964569-A2 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of viral infections Pharmasset, Inc. (US) 2008-09-03 EP disclosed
US-7094770-B2 3′-or 2′-hydroxymethyl substituted nucleoside derivatives for treatment of hepatitis virus infections PHARMASSET, LTD. (BB) 2006-08-22 US disclosed
US-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections PHARMASSET, INC. 2002-05-09 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-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections HCCS, HDGF, HMBS P2RY6 2891/4885P2RY14 3354/4885NT5E 452/4885

“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.