SCHEMBL6018620

SCHEMBL6018620

CC(C)=CC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)OC(C(=O)O)=C[C@@H]1O

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NEU1 Q99519 16/20 0.79
NEU2 Q9Y3R4 12/20 0.79
NEU4 Q8WWR8 7/20 0.79
NEU3 Q9UQ49 7/20 0.79

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
Neu5Ac2En SCHEMBL19454809 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL14080015 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL13839147 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL2631455 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL2619259 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL24387783 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL10054709 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL22263416 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
Neu5Ac2En SCHEMBL21125943 0.88 NEU2 (1.00) NEU1NEU2NEU4NEU3
SCHEMBL6018868 0.87 NEU1 (0.73) NEU1NEU2NEU4NEU3

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
US-7045535-B2 Compounds useful for inhibiting paramyxovirus neuraminidase BIOCRYST PHARMACEUTICALS, INC. (US) 2006-05-16 US claimed
US-20030187063-A1 Compounds useful for inhibiting paramyxovirus neuraminidase BIOCRYST PHARMACEUTICALS, INC. 2003-10-02 US claimed
US-7045535-B2 Compounds useful for inhibiting paramyxovirus neuraminidase BIOCRYST PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
US-20030187063-A1 Compounds useful for inhibiting paramyxovirus neuraminidase BIOCRYST PHARMACEUTICALS, INC. 2003-10-02 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-20030187063-A1 Compounds useful for inhibiting paramyxovirus neuraminidase SCN10A, NEU1, NEU4 NEU1 2/4885NEU2 6/4885NEU4 3/4885

“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.