SCHEMBL12596285

SCHEMBL12596285

C=C1C[C@@H](n2cc(F)c(=O)[nH]c2=O)O[C@H]1COC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 2/20 0.46
ESR1 P03372 1/20 0.46
TSHR P16473 1/20 0.41
PMP22 Q01453 1/20 0.41
HBB P68871 1/20 0.41
TYMS P04818 1/20 0.41
P2RY6 Q15077 2/20 0.40
P2RY14 Q15391 2/20 0.40
NT5E P21589 1/20 0.40
TK1 P04183 1/20 0.38

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
SCHEMBL12595726 0.83 LMNA (0.65) LMNASMN1; SMN2MAPTESR1TSHR
SCHEMBL4277166 0.80 LMNA (0.70) LMNASMN1; SMN2TYMSTK1
SCHEMBL9856524 0.80 LMNA (0.57) LMNASMN1; SMN2MAPTESR1TYMS
SCHEMBL4277164 0.80 LMNA (0.70) LMNASMN1; SMN2TYMSTK1
SCHEMBL570200 0.78 LMNA (0.55) LMNASMN1; SMN2MAPTESR1TYMS
SCHEMBL8329362 0.78 LMNA (0.55) LMNASMN1; SMN2MAPTESR1TYMS
SCHEMBL8329365 0.77 LMNA (0.44) LMNASMN1; SMN2MAPTESR1TSHR
SCHEMBL4276828 0.74 LMNA (0.51) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL25061415 0.73 TK1 (0.47) TK1
SCHEMBL9098319 0.73 TYMS (0.53) LMNASMN1; SMN2TYMSTK1

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-20120309705-A1 NOVEL 3'-DEOXY-3'-METHYLIDENE-BETA-L-NUCLEOSIDES NOVADEX PHARMACEUTICALS AB (SE) 2012-12-06 US disclosed
WO-2011075052-A1 NOVEL 3´-DEOXY-3´-METHYLIDENE- -L-NUCLEOSIDES NOVADEX PHARMACEUTICALS AB (SE) 2011-06-23 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-20120309705-A1 NOVEL 3'-DEOXY-3'-METHYLIDENE-BETA-L-NUCLEOSIDES ENTPD5, MTAP, SLC29A1 LMNA 262/4885SMN1; SMN2 3178/4885MAPT 3753/4885

“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.