SCHEMBL26311389

SCHEMBL26311389

Cc1nc(N)c2ncn(C3OC(CO)(N=[N+]=[N-])C(O)C3F)c2n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 6/20 0.42
▸ ADORA3 P0DMS8 3/20 0.42
▸ ADORA1 P30542 2/20 0.42
▸ PDE2A O00408 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ RNASEL Q05823 3/20 0.40
▸ HIF1A Q16665 2/20 0.40
▸ DNMT1 P26358 1/20 0.40
▸ DNMT3B Q9UBC3 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ NT5E P21589 1/20 0.40
▸ AHCY P23526 1/20 0.39
▸ ADORA2B P29275 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.38

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
SCHEMBL21614180 0.90 NT5E (0.52) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL17927851 0.85 AHCY (0.55) ADORA2AADORA3ADORA1HIF1AAHCY
SCHEMBL16214136 0.85 AHCY (0.55) ADORA2AADORA3ADORA1HIF1AAHCY
SCHEMBL24831397 0.85 AHCY (0.55) ADORA2AADORA3ADORA1HIF1AAHCY
SCHEMBL16214098 0.83 SLC29A1 (0.38) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL16214124 0.82 SLC29A1 (0.38) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL26311386 0.82 AHCY (0.45) ADORA2AADORA3ADORA1PDE2AADRA1A
SCHEMBL16214074 0.82 AHCY (0.41) ADORA2AADORA3ADORA1HIF1AAHCY
SCHEMBL16858614 0.81 ADORA3 (0.48) ADORA3PDE3ANT5E
SCHEMBL16214090 0.81 ADORA3 (0.48) ADORA3PDE3ANT5E

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-20230277576-A1 A METHOD FOR PREVENTING OR TREATING A CORNAVIRUS INFECTIOUS DISEASE HENAN GENUINE BIOTECH CO., LTD. (CN) 2023-09-07 — — 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-20230277576-A1 A METHOD FOR PREVENTING OR TREATING A CORNAVIRUS INFECTIOUS DISEASE ACE, ACE2, SARS1 ADORA2A 4232/4885ADORA3 3008/4885ADORA1 2493/4885

“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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