SCHEMBL16144257

SCHEMBL16144257

COc1ccc(C(O[C@H]2[C@@H](F)[C@H](C)O[C@]2(F)CO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.35
KCNH2 Q12809 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A1 P30531 2/20 0.33
SLC6A11 P48066 1/20 0.33
NPY2R P49146 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
SCHEMBL16144258 0.78 P2RY14 (0.37)
SCHEMBL16144610 0.78 ALDH1A1 (0.32) KIF11LMNASLC6A1SLC6A11
SCHEMBL16144281 0.76 PDE3A (0.36) KIF11LMNA
SCHEMBL26355010 0.70 KIF11 (0.36) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL16144259 0.69 P2RY14 (0.36)
SCHEMBL25400121 0.69 P2RY14 (0.37)
SCHEMBL26355004 0.68 KIF11 (0.40) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL25399622 0.67 TK2 (0.39)
SCHEMBL25400989 0.67 HSP90AA1 (0.41) LMNASMN1; SMN2
SCHEMBL25400287 0.67 TK2 (0.39)

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-9187515-B2 2′,4′-fluoro nucleosides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2015-11-17 US disclosed
US-20140294769-A1 2',4'-FLUORO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC 2014-10-02 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-20140294769-A1 2',4'-FLUORO NUCLEOSIDES FOR THE TREATMENT OF HCV SLC29A1, SLC28A1, SLC10A1 KIF11 502/4885KCNH2 4199/4885LMNA 3329/4885

“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.