SCHEMBL14389751

SCHEMBL14389751

BP(=O)(OC[C@H]1O[C@@H](n2ccc3c(NC(C)=O)ncnc32)[C@](C)(O)C1O)OP(=O)(O)C(F)(F)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 5/20 0.41
▸ P2RY4 P51582 4/20 0.41
▸ GK P32189 1/20 0.38
▸ POLA1 P09884 1/20 0.36
▸ P2RY6 Q15077 4/20 0.36
▸ PRMT5 O14744 3/20 0.36
▸ WDR77 Q9BQA1 3/20 0.36
▸ ADORA3 P0DMS8 3/20 0.36
▸ P2RY14 Q15391 1/20 0.34
▸ ADORA2A P29274 2/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ ADORA1 P30542 1/20 0.33

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
SCHEMBL14378923 0.87 GK (0.47) P2RY2P2RY4GKPRMT5WDR77
SCHEMBL14378919 0.86 GK (0.34) P2RY2P2RY4GKPOLA1P2RY6
SCHEMBL13005782 0.72 P2RY2 (0.38) P2RY2P2RY4GKP2RY6P2RY14
SCHEMBL1738161 0.72 PRMT5 (0.55) P2RY2P2RY4PRMT5WDR77ADORA2A
SCHEMBL14544364 0.72 PRMT5 (0.55) P2RY2P2RY4PRMT5WDR77ADORA2A
SCHEMBL14094798 0.71 P2RY2 (0.41) P2RY2P2RY4GKPOLA1P2RY6
SCHEMBL14154286 0.71 ADK (0.44) PRMT5WDR77ADORA3ADORA2AADORA2B
SCHEMBL14782087 0.71 P2RY2 (0.61) P2RY2P2RY4POLA1PRMT5WDR77
SCHEMBL1739812 0.71 P2RY2 (0.61) P2RY2P2RY4POLA1PRMT5WDR77
SCHEMBL21006619 0.70 P2RY2 (0.63) P2RY2P2RY4POLA1PRMT5WDR77

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-7598230-B2 For the treatment of viral infections, microbial infections, and proliferative disorders; contain di- or triphosphate moeity mimetics, such as those containing boron anions BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2009-10-06 — — US disclosed
US-20070259832-A1 Nucleotide mimics and their prodrugs BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2007-11-08 — — 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-20070259832-A1 Nucleotide mimics and their prodrugs NUDT14, ENTPD5, MTAP P2RY2 104/4885P2RY4 46/4885GK 1449/4885

“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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