SCHEMBL15828255

SCHEMBL15828255

B[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)C2OC(C)(C)OC21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ HPGD P15428 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ CYP3A4 P08684 5/20 0.35
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ CYP2D6 P10635 3/20 0.32
▸ TSHR P16473 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ PKM P14618 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
SCHEMBL7767515 0.87 HPGD (0.43) CA2CA1CA9HPGDRXFP1
SCHEMBL6269225 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL7148753 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL1308779 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL13290042 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL13800900 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL6241033 0.87 CA2 (0.41) CA2CA1CA9HPGDRXFP1
SCHEMBL15685476 0.85 CA2 (0.61) CA2CA1CA9HPGDRXFP1
SCHEMBL15833416 0.85 CA2 (0.61) CA2CA1CA9HPGDRXFP1
SCHEMBL4587323 0.85 CA2 (0.61) CA2CA1CA9HPGDRXFP1

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
US-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV UNIVERSITE DE MONTPELLIER (FR) 2014-06-26 — — US disclosed
WO-2014099941-A1 4'-FLUORO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2014-06-26 — — 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-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV FBL, HNRNPLL, SLC28A1 CA2 4556/4885CA1 4408/4885CA9 4350/4885

“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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