SCHEMBL14010236

SCHEMBL14010236

C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cc(F)c2c(-n3cnnc3)nc(N)nc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 9/20 0.46
▸ ADA P00813 1/20 0.43
▸ ADORA3 P0DMS8 11/20 0.38
▸ ADORA1 P30542 8/20 0.38
▸ ADORA2B P29275 4/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ PDE4D Q08499 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ SLC29A1 Q99808 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 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
SCHEMBL5006780 0.86 ADORA2A (0.51) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL14010205 0.80 ADORA2A (0.43) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL27699336 0.77 ADORA2A (0.50) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL5008834 0.77 ADORA2A (0.46) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL24837545 0.76 ADORA2A (0.65) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL15759356 0.76 ADORA2A (0.65) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL731182 0.76 ADORA2A (0.65) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL12149498 0.76 ADORA2A (0.65) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL3292590 0.76 ADORA2A (0.51) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL13005683 0.76 ADORA2A (0.51) ADORA2AADAADORA3ADORA1ADORA2B

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-20080280842-A1 Fluorinated Pyrrolo[2,3-D]Pyrimidine Nucleosides for the Treatment of Rna-Dependent Rna Viral Infection MERCK & CO., INC. (US) 2008-11-13 — — 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-20080280842-A1 Fluorinated Pyrrolo[2,3-D]Pyrimidine Nucleosides for the Treatment of Rna-Dependent Rna Viral Infection NSUN2, DUT, EFTUD2 ADORA2A 444/4885ADA 438/4885ADORA3 238/4885

“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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