SCHEMBL16871817

SCHEMBL16871817

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(-c5cccc6ccccc56)ncnc43)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYMP P19971 8/20 0.38
ADORA1 P30542 2/20 0.32
DNPH1 O43598 2/20 0.32
GAPDH P04406 2/20 0.30

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
SCHEMBL16871856 0.91 TYMP (0.39) TYMPADORA1DNPH1
SCHEMBL16871849 0.91 TYMP (0.41) TYMPADORA1DNPH1
SCHEMBL18486341 0.90 TYMP (0.38) TYMPADORA1DNPH1
SCHEMBL18486198 0.90 TYMP (0.38) TYMPADORA1DNPH1
SCHEMBL16871812 0.89 TYMP (0.39) TYMPADORA1DNPH1
SCHEMBL16871898 0.89 TYMP (0.38) TYMPADORA1DNPH1
SCHEMBL16871825 0.88 TYMP (0.38) TYMPADORA1DNPH1
SCHEMBL18486222 0.87 TYMP (0.37) TYMPADORA1DNPH1
SCHEMBL18486307 0.87 DNPH1 (0.38) TYMPADORA1DNPH1
SCHEMBL24191249 0.87 TYMP (0.47) TYMPADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2891717-B1 OLIGONUCLEOTIDE KYOWA KIRIN CO LTD (JP) 2020-04-29 EP disclosed
US-10378011-B2 Oligonucleotide KYOWA HAKKO KIRIN CO., LTD. (JP) 2019-08-13 US disclosed
US-10342819-B2 Oligonucleotide having non-natural nucleotide at 5′-terminal thereof KYOWA HAKKO KIRIN CO., LTD. (JP) 2019-07-09 US disclosed
US-20170354673-A1 OLIGONUCLEOTIDE HAVING NON-NATURAL NUCLEOTIDE AT 5'-TERMINAL THEREOF KYOWA HAKKO KIRIN CO., LTD. (JP) 2017-12-14 US disclosed
EP-3130597-A1 OLIGONUCLEOTIDE HAVING NON-NATURAL NUCLEOTIDE AT 5'-TERMINAL THEREOF Kyowa Hakko Kirin Co., Ltd. (JP) 2017-02-15 EP disclosed
US-20150376611-A1 OLIGONUCLEOTIDE KYOWA KIRIN CO., LTD. (JP) 2015-12-31 US disclosed
EP-2891717-A1 OLIGONUCLEOTIDE Kyowa Hakko Kirin Co., Ltd. (JP) 2015-07-08 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 (3 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-10378011-B2 Oligonucleotide HNRNPA3, AGO2, RBM3 TYMP 2518/4885ADORA1 2175/4885DNPH1 4323/4885
US-10342819-B2 Oligonucleotide having non-natural nucleotide at 5′-terminal thereof RNGTT, UPF1, NSUN3 TYMP 120/4885ADORA1 529/4885DNPH1 2051/4885
US-20170354673-A1 OLIGONUCLEOTIDE HAVING NON-NATURAL NUCLEOTIDE AT 5'-TERMINAL THEREOF RNGTT, UPF1, NSUN3 TYMP 121/4885ADORA1 539/4885DNPH1 2035/4885

“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.