SCHEMBL19689066

SCHEMBL19689066

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NCc5cccc(C(=O)OCCC#N)c5)ncnc43)C[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAPDH P04406 2/20 0.35
TYMP P19971 2/20 0.35
ADORA3 P0DMS8 2/20 0.34
DOT1L Q8TEK3 1/20 0.34
DNPH1 O43598 1/20 0.34

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
SCHEMBL18486210 0.95 GAPDH (0.37) GAPDHTYMPADORA3
SCHEMBL18486235 0.92 ADORA3 (0.39) TYMPADORA3DOT1LDNPH1
SCHEMBL18486345 0.90 TYMP (0.34) GAPDHTYMPADORA3DOT1LDNPH1
SCHEMBL29449394 0.89 TYMP (0.39) GAPDHTYMP
SCHEMBL2054229 0.89 TYMP (0.39) GAPDHTYMP
SCHEMBL29674590 0.89 TYMP (0.39) GAPDHTYMP
SCHEMBL15786367 0.89 TYMP (0.39) GAPDHTYMP
SCHEMBL18486218 0.88 TYMP (0.46) GAPDHTYMPADORA3DNPH1
SCHEMBL19689075 0.87 DNPH1 (0.42) TYMPDNPH1
SCHEMBL24354782 0.86 TYMP (0.38) TYMPADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-10342819-B2 Oligonucleotide having non-natural nucleotide at 5′-terminal thereof RNGTT, UPF1, NSUN3 GAPDH 3015/4885TYMP 120/4885ADORA3 127/4885
US-20170354673-A1 OLIGONUCLEOTIDE HAVING NON-NATURAL NUCLEOTIDE AT 5'-TERMINAL THEREOF RNGTT, UPF1, NSUN3 GAPDH 3018/4885TYMP 121/4885ADORA3 134/4885

“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.