SCHEMBL26326721

SCHEMBL26326721

N=C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](COP(=O)(O)OC[C@H](O)CO)C(O)C1O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.37
▸ P2RY2 P41231 3/20 0.35
▸ P2RY4 P51582 1/20 0.35
▸ P2RY6 Q15077 1/20 0.35
▸ P2RY14 Q15391 1/20 0.35
▸ P2RY1 P47900 3/20 0.31
▸ SRC P12931 1/20 0.31
▸ P2RX1 P51575 1/20 0.31
▸ P2RX3 P56373 1/20 0.31
▸ P2RX4 Q99571 1/20 0.31
▸ P2RX2 Q9UBL9 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ RARS1 P54136 1/20 0.31
▸ FHIT P49789 1/20 0.31
▸ TMPRSS2 O15393 1/20 0.31

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
SCHEMBL26327762 0.90 POLRMT (0.39) POLRMTP2RY2P2RY4P2RY6P2RY14
SCHEMBL26326450 0.86 POLRMT (0.35) POLRMTP2RY2
SCHEMBL26326550 0.86 POLRMT (0.33) POLRMT
SCHEMBL26326530 0.85 POLRMT (0.33) POLRMT
SCHEMBL26326602 0.84 POLRMT (0.32) POLRMT
SCHEMBL26326630 0.83 POLRMT (0.33) POLRMT
SCHEMBL26326574 0.83 POLRMT (0.33) POLRMT
SCHEMBL26326474 0.81 POLRMT (0.31) POLRMT
SCHEMBL25911561 0.81 ADK (0.36) POLRMT
SCHEMBL26327759 0.80 POLRMT (0.33) POLRMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287029-A1 ANTIVIRAL PRODRUGS, PHARMACEUTICAL FORMULATIONS, AND METHODS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-09-14 — — 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-20230287029-A1 ANTIVIRAL PRODRUGS, PHARMACEUTICAL FORMULATIONS, AND METHODS MTAP, SARS1, RNGTT POLRMT 20/4885P2RY2 702/4885P2RY4 222/4885

“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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