SCHEMBL5583939

SCHEMBL5583939

C=CCc1cn([C@@H]2OC(CO)[C@@H](O)[C@H]2OF)c(=O)nc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 4/20 0.43
LMNA P02545 3/20 0.43
MTOR P42345 2/20 0.43
ALDH1A1 P00352 2/20 0.43
THRB P10828 1/20 0.43
MDM2 Q00987 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
GMNN O75496 1/20 0.43
TP53 P04637 1/20 0.43
NFKB1 P19838 1/20 0.43
THPO P40225 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
HBB P68871 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
ADORA1 P30542 1/20 0.38

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
SCHEMBL4418542 0.88 LMNA (0.56) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL2583348 0.88 LMNA (0.56) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL4418541 0.88 LMNA (0.56) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL11332590 0.88 LMNA (0.56) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL2338693 0.83 LMNA (0.46) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL5697563 0.83 LMNA (0.46) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL7194470 0.83 LMNA (0.46) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL28077035 0.83 LMNA (0.46) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL2582377 0.82 DNMT1 (0.40) DNMT1LMNAMTORALDH1A1THRB
SCHEMBL25279627 0.79 LMNA (0.46) DNMT1LMNAMTORALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232798-A1 Process For The Synthesis Of 2'-O-Substituted Pyrimidines And Oligomeric Compounds Therefrom COOK PHILLIP D 2007-10-04 US disclosed
US-20050059815-A1 Processes for the synthesis of 2'-O-substituted pyrimidines and oligomeric compounds therefrom COOK PHILLIP DAN (US) 2005-03-17 US disclosed
US-6642367-B2 Oligonucleotide sfor use in the treatment of cancer and viral diseases ISIS PHARMACEUTICALS, INC. 2003-11-04 US disclosed
US-20030050454-A1 Process for the synthesis of 2' -O-substituted pyrimidines and oligomeric compounds therefrom ISIS PHARMACEUTICALS, INC. 2003-03-13 US disclosed
US-6222025-B1 OLIGONUCLEOTIDES HAVING 2' AND 5 SUBSTITUTED PYRIMIDINE NUCLEOTIDES; INCREASED AFFINITY FOR NUCLEIC ACIDS; INCREASED NUCLEASE RESISTANCE ISIS PHARMACEUTICALS, INC. 2001-04-24 US disclosed
US-6166197-A Oligomeric compounds having pyrimidine nucleotide (S) with 2'and 5 substitutions ISIS PHARMACEUTICALS, INC. (US) 2000-12-26 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 (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-20050059815-A1 Processes for the synthesis of 2'-O-substituted pyrimidines and oligomeric compounds therefrom NUDT1, DPYD, UMPS DNMT1 101/4885LMNA 3765/4885MTOR 4149/4885
US-20070232798-A1 Process For The Synthesis Of 2'-O-Substituted Pyrimidines And Oligomeric Compounds Therefrom TYMS, RRM2, ATIC DNMT1 154/4885LMNA 3653/4885MTOR 3991/4885
US-20030050454-A1 Process for the synthesis of 2' -O-substituted pyrimidines and oligomeric compounds therefrom ATIC, TYMS, RRM2 DNMT1 192/4885LMNA 3797/4885MTOR 4007/4885

“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.