SCHEMBL15828241

SCHEMBL15828241

CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@@]1(F)O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ TAAR1 Q96RJ0 2/20 0.46
▸ HINT1 P49773 2/20 0.44
▸ TAS1R3 Q7RTX0 1/20 0.43
▸ TAS1R1 Q7RTX1 1/20 0.43
▸ TGM2 P21980 1/20 0.41
▸ NT5E P21589 1/20 0.40
▸ GSK3A P49840 1/20 0.40
▸ RPS6KA3 P51812 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ KRAS P01116 3/20 0.40
▸ PNP P00491 1/20 0.39

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
SCHEMBL15828252 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15588586 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828282 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828287 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828243 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828286 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828270 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15588566 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828311 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3
SCHEMBL15828250 1.00 CYP3A4 (0.47) CYP3A4CYP2C9TAAR1HINT1TAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9211300-B2 4′-fluoro nucleosides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2015-12-15 — — US disclosed
WO-2014099941-A1 4'-FLUORO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2014-06-26 — — WO disclosed
US-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV UNIVERSITE DE MONTPELLIER (FR) 2014-06-26 — — 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-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV FBL, HNRNPLL, SLC28A1 CYP3A4 1243/4885CYP2C9 3023/4885TAAR1 2325/4885

“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.

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