SCHEMBL26808396

SCHEMBL26808396

Nc1nc2c(ncn2[C@@H]2O[C@H](CO)C(CCc3ccccc3)[C@@H]2O)c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HINT1 P49773 2/20 0.60
ADORA3 P0DMS8 6/20 0.56
ADORA1 P30542 5/20 0.56
HPGD P15428 2/20 0.54
ADORA2A P29274 7/20 0.54
ADORA2B P29275 4/20 0.54
SLC29A1 Q99808 1/20 0.54
GSK3A P49840 1/20 0.53
RPS6KA3 P51812 1/20 0.53
MAPK14 Q16539 1/20 0.53
TAAR1 Q96RJ0 1/20 0.53
NT5E P21589 1/20 0.52

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
SCHEMBL26808259 1.00 HINT1 (0.60) HINT1ADORA3ADORA1HPGDADORA2A
SCHEMBL26208037 0.89 HINT1 (0.58) HINT1ADORA3ADORA1HPGDADORA2A
SCHEMBL26622676 0.87 HINT1 (0.62) HINT1ADORA3ADORA1HPGDADORA2A
SCHEMBL25711664 0.87 HPGD (0.64) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL17198349 0.87 HPGD (0.64) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL20248685 0.87 HPGD (0.64) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL26211537 0.86 HINT1 (0.56) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL26622897 0.86 HINT1 (0.61) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL26808338 0.85 HINT1 (0.51) HINT1ADORA3ADORA1HPGDADORA2A
SCHEMBL17198483 0.85 HPGD (0.61) HINT1HPGDGSK3ARPS6KA3MAPK14

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-20230357306-A1 SYNTHESIS OF 1,2,5-TRI-O-BENZOYL-3-DIBENZYLAMINO-3-DEOXYRIBOSE AS INTERMEDIATE FOR PRODUCING 3'-AMINO-3'-DEOXYADENOSINE AND 3'-AMINO-3'-DEOXYGUANOSINE AND THE PROTECTED DERIVATIVES THEREOF BRISTOL MYERS SQUIBB CO (US) 2023-11-09 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-20230357306-A1 SYNTHESIS OF 1,2,5-TRI-O-BENZOYL-3-DIBENZYLAMINO-3-DEOXYRIBOSE AS INTERMEDIATE FOR PRODUCING 3'-AMINO-3'-DEOXYADENOSINE AND 3'-AMINO-3'-DEOXYGUANOSINE AND THE PROTECTED DERIVATIVES THEREOF STING1, CGAS, AMPD3 HINT1 152/4885ADORA3 38/4885ADORA1 69/4885

“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.