SCHEMBL5369550

SCHEMBL5369550

Nc1ncnc2c1nc(NCCP(=O)(O)O)n2[C@@H]1O[C@H](CO)C(O)C1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 1.00
HSPA8 P11142 7/20 0.72
HSPA5 P11021 3/20 0.72
RXFP1 Q9HBX9 1/20 0.72
SLC28A2 O43868 10/20 0.67

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
SCHEMBL5369521 1.00 FBP1 (1.00) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL6762435 0.88 FBP1 (0.79) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL6762443 0.88 FBP1 (0.79) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL13835142 0.86 FBP1 (0.75) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL13835141 0.86 FBP1 (0.75) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL1661023 0.85 HSPA8 (0.74) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL14380122 0.85 HSPA8 (0.74) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL1661019 0.85 HSPA8 (0.74) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL13127208 0.84 HSPA8 (0.80) FBP1HSPA8HSPA5RXFP1SLC28A2
SCHEMBL6763143 0.84 HSPA8 (0.80) FBP1HSPA8HSPA5RXFP1SLC28A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7285543-B2 Purine inhibitors of fructose-1,6-bisphosphatase METABASIS THERAPEUTICS, INC. (US) 2007-10-23 US disclosed
US-20050277619-A1 Novel purine inhibitors of fructose-1,6-bisphosphatase DANG QUN 2005-12-15 US disclosed
US-6967193-B1 Purine inhibitors of fructose-1,6-bisphosphatase METABASIS THERAPEUTICS, INC. (US) 2005-11-22 US disclosed
US-6284748-B1 ANTIDIABETIC AGENT METABASIS THERAPEUTICS, INC. 2001-09-04 US disclosed
WO-1998039344-A9 NOVEL PURINE INHIBITORS OF FRUCTOSE-1,6-BISPHOSPHATASE 1999-01-21 WO disclosed
WO-1998039344-A1 NOVEL PURINE INHIBITORS OF FRUCTOSE-1,6-BISPHOSPHATASE METABASIS THERAPEUTICS, INC. (US) 1998-09-11 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-20050277619-A1 Novel purine inhibitors of fructose-1,6-bisphosphatase FBP1, PNP, PPA1 FBP1 1/4885HSPA8 3807/4885HSPA5 2661/4885

“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.