SCHEMBL6424816

SCHEMBL6424816

COc1ccc(C(OC[C@@]23CCO[C@@H]([C@H](n4cnc5c(NC(=O)c6ccccc6)ncnc54)O2)[C@@H]3O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYMP P19971 1/20 0.43
ADORA2B P29275 3/20 0.42
ADORA2A P29274 2/20 0.42
ADORA1 P30542 2/20 0.39
ADORA3 P0DMS8 3/20 0.39

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
SCHEMBL29529257 0.93 ADORA3 (0.44) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL24512768 0.93 ADORA3 (0.44) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL1097143 0.93 ADORA3 (0.44) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL19814055 0.93 ADORA3 (0.44) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL31390282 0.88 TYMP (0.42) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL22594746 0.88 ADORA3 (0.43) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL25630100 0.86 TYMP (0.40) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL29610113 0.85 ADORA3 (0.45) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL20394061 0.85 ADORA3 (0.45) TYMPADORA2BADORA2AADORA1ADORA3
SCHEMBL21750447 0.85 TYMP (0.39) TYMPADORA2BADORA2AADORA1ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1152009-B2 NOVEL NUCLEOSIDES AND OLIGONUCLEOTIDE ANALOGUES DAIICHI SANKYO CO LTD (JP) 2017-09-06 EP claimed
US-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-11-02 US disclosed
EP-1152009-B2 NOVEL NUCLEOSIDES AND OLIGONUCLEOTIDE ANALOGUES DAIICHI SANKYO CO LTD (JP) 2017-09-06 EP disclosed
EP-1152009-B1 NOVEL NUCLEOSIDES AND OLIGONUCLEOTIDE ANALOGUES SANKYO CO (JP) 2005-01-26 EP 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-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE PFAS, ENPP1, NAAA TYMP 113/4885ADORA2B 2249/4885ADORA2A 2111/4885

“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.