SCHEMBL2030341

SCHEMBL2030341

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@H]2O[C@@H](n3cc(C#N)c(=O)[nH]c3=O)C[C@@H]2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYMS P04818 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
TK1 P04183 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
SCHEMBL16177319 0.91 TYMS (0.42) TYMSTK1
SCHEMBL2030339 0.89 TK1 (0.38) TYMSTK1
SCHEMBL7535867 0.88 TK1 (0.52) TYMSTK1
SCHEMBL9564565 0.88 TK1 (0.52) TYMSTK1
SCHEMBL60737 0.88 TK1 (0.52) TYMSTK1
SCHEMBL5486404 0.87 LMNA (0.47) TYMSTK1
SCHEMBL5086844 0.87 TK1 (0.47) TYMSTK1
SCHEMBL1501551 0.87 TYMS (0.44) TYMSTK1
SCHEMBL7602619 0.86 TK1 (0.43) TYMSTK1
SCHEMBL2027058 0.86 LMNA (0.50) TYMSTK1

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
US-8268978-B2 Modified oligonucleotides and applications thereof APPLIED BIOSYSTEMS, LLC (US) 2012-09-18 US disclosed
US-20110144319-A1 Modified Oligonucleotides and Applications Thereof Life Technologies Corporation (US) 2011-06-16 US disclosed
US-7807376-B2 Modified oligonucleotides and applications thereof Life Technologies Corporation (US) 2010-10-05 US disclosed
US-20100112712-A1 Modified Oligonucleotides and Applications Thereof Life Technologies Corporation (US) 2010-05-06 US disclosed
US-7585649-B2 Modified oligonucleotides and applications thereof APPLIED BIOSYSTEMS, LLC (US) 2009-09-08 US disclosed
US-20090148846-A1 Modified Oligonucleotides and Applications Thereof APPLIED BIOSYSTEMS INC. (US) 2009-06-11 US disclosed
US-7414118-B1 Modified oligonucleotides and applications thereof APPLIED BIOSYSTEMS INC. (US) 2008-08-19 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-20110144319-A1 Modified Oligonucleotides and Applications Thereof RNGTT, POLRMT, POLM TYMS 57/4885L3MBTL1 1684/4885TK1 170/4885
US-20100112712-A1 Modified Oligonucleotides and Applications Thereof RNGTT, POLRMT, POLM TYMS 57/4885L3MBTL1 1684/4885TK1 170/4885

“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.