SCHEMBL6790556

SCHEMBL6790556

NC(=O)c1ccnc([C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UMPS P11172 1/20 0.44
PYGL P06737 3/20 0.42
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
GLA P06280 1/20 0.41
EIF4E P06730 1/20 0.41
CYP3A4 P08684 1/20 0.41
TOP1 P11387 1/20 0.41
ADORA1 P30542 1/20 0.41
THPO P40225 1/20 0.41
PMP22 Q01453 1/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
BLM P54132 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL13514156 1.00 UMPS (0.44) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL12693897 1.00 UMPS (0.44) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL12691584 1.00 UMPS (0.44) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL4270606 1.00 UMPS (0.44) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL6931518 1.00 UMPS (0.44) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL6789884 0.84 KDM4E (0.46) ALDH1A1KDM4ESLC5A2
SCHEMBL6789430 0.84 KDM4E (0.46) ALDH1A1KDM4ESLC5A2
SCHEMBL4965716 0.80 UMPS (0.45) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL17479553 0.80 UMPS (0.45) UMPSPYGLLMNASMN1; SMN2ALDH1A1
SCHEMBL6789429 0.78 SLC5A2 (0.45) PYGLLMNASMN1; SMN2TSHRCYP3A4

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-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections PHARMASSET, INC. 2004-12-30 US disclosed
CN-1527836-A Antiviral agents for treatment of flaviviridae infections 2004-09-08 CN 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-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections HAVCR2, MAVS, EIF2AK2 UMPS 454/4885PYGL 81/4885LMNA 4363/4885

“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.