SCHEMBL6880850

SCHEMBL6880850

CC(=O)Nc1nc2c(ncn2[C@H]2O[C@@H]3COC([C@H]2COC(C)=O)[C@@H]3OCc2ccccc2)c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.49
TAS1R1 Q7RTX1 2/20 0.49
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.42
BCHE P06276 2/20 0.40
HINT1 P49773 1/20 0.40
ACHE P22303 3/20 0.38
KDM4E B2RXH2 1/20 0.37
IMPDH2 P12268 1/20 0.36
NT5E P21589 1/20 0.36
POLA1 P09884 1/20 0.35

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
SCHEMBL6875722 0.80 TYMP (0.41) ALDH1A1BCHEACHE
SCHEMBL7699861 0.78 TK1 (0.45) BCHE
SCHEMBL7707747 0.77 TDP1 (0.40) MEN1KMT2ANT5E
SCHEMBL6874990 0.74 TAS1R3 (0.42) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL7699092 0.74 TAS1R3 (0.42) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL6877611 0.74 TAS1R3 (0.42) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL25410125 0.72 ALDH1A1 (0.63) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL8593102 0.72 ALDH1A1 (0.63) TAS1R3TAS1R1ALDH1A1MEN1KMT2A
SCHEMBL2027278 0.72 TAS1R3 (0.80) TAS1R3TAS1R1MEN1KMT2ATSHR
SCHEMBL8970362 0.71 TAS1R3 (0.60) TAS1R3TAS1R1ALDH1A1MEN1KMT2A

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-6833361-B2 Compound for use in the treatment of viral diseases RIBAPHARM, INC. 2004-12-21 US disclosed
US-20030028013-A1 Novel nucleosides having bicyclic sugar moiety CEQUENT PHARMACEUTICALS, INC. 2003-02-06 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-20030028013-A1 Novel nucleosides having bicyclic sugar moiety DCK, NUDT14, UCK2 TAS1R3 4198/4885TAS1R1 4298/4885ALDH1A1 3461/4885

“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.