SCHEMBL3363487

SCHEMBL3363487

Nc1nc(=O)n(C2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1F

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
MTOR P42345 2/20 0.62
ALDH1A1 P00352 2/20 0.62
THRB P10828 1/20 0.62
MDM2 Q00987 1/20 0.62
NCOA1 Q15788 1/20 0.62
NCOA3 Q9Y6Q9 1/20 0.62
GMNN O75496 1/20 0.62
TP53 P04637 1/20 0.62
NFKB1 P19838 1/20 0.62
DNMT1 P26358 1/20 0.62
THPO P40225 1/20 0.62
HTT P42858 1/20 0.62
RAB9A P51151 1/20 0.62
BLM P54132 1/20 0.62
HBB P68871 1/20 0.62
PMP22 Q01453 1/20 0.62
ALB P02768 1/20 0.54
NT5E P21589 1/20 0.53
HIF1A Q16665 1/20 0.53

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
SCHEMBL18870816 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL207772 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL1230711 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL5697575 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL2583898 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL16805415 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL547089 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL4286246 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL21423108 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2
SCHEMBL30694436 1.00 LMNA (0.62) LMNAMTORALDH1A1THRBMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070859-A1 Compounds resistant to metabolic deactivation and methods of use KANE ROBERT R 2008-03-20 US claimed
US-20060122144-A1 Compounds resistant to metabolic deactivation and methods of use KANE ROBERT R 2006-06-08 US claimed
EP-1581547-A2 COMPOUNDS RESISTANT TO METABOLIC DEACTIVATION AND METHODS OF USE BAYLOR UNIVERSITY (US) 2005-10-05 EP claimed
WO-2004050678-A2 COMPOUNDS RESISTANT TO METABOLIC DEACTIVATION AND METHODS OF USE BAYLOR UNIVERSITY (US) 2004-06-17 WO claimed
US-20120149888-A1 SYNTHESIS OF ARA-2'-O-METHYL-NUCLEOSIDES, CORRESPONDING PHOSPHORAMIDITES AND OLIGONUCLEOTIDES INCORPORATING NOVEL MODIFICATIONS FOR BIOLOGICAL APPLICATION IN THERAPEUCTICS, DIAGNOSTICS, G- TETRAD FORMING OLIGONUCLEOTIDES AND APTAMERS CHEMGENES CORPORATION 2012-06-14 US disclosed
WO-2010037134-A2 MULTI-STAGE STEM CELL CARCINOGENESIS STEMLIFELINE, INC. (US) 2010-04-01 WO disclosed
US-20080070859-A1 Compounds resistant to metabolic deactivation and methods of use KANE ROBERT R 2008-03-20 US disclosed
EP-1812456-A2 ß-L-N4-HYDROXYCYTOSINE DEOXYNUCLEOSIDES AND THEIR USE AS PHARMACEUTICAL AGENTS IN THE PROPHYLAXIS OR THERAPY OF VIRAL DISEASES MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN (DE) 2007-08-01 EP disclosed
US-20060122144-A1 Compounds resistant to metabolic deactivation and methods of use KANE ROBERT R 2006-06-08 US disclosed
WO-2006045616-A2 β-L-N4-HYDROXYCYTOSINE DEOXYNUCLEOSIDES AND THEIR USE AS PHARMACEUTICAL AGENTS IN THE PROPHYLAXIS OR THERAPY OF VIRAL DISEASES Max-Delbrück-Centrum für Molekulare Medizin (DE) 2006-05-04 WO disclosed
EP-1581547-A2 COMPOUNDS RESISTANT TO METABOLIC DEACTIVATION AND METHODS OF USE BAYLOR UNIVERSITY (US) 2005-10-05 EP disclosed
WO-2004050678-A2 COMPOUNDS RESISTANT TO METABOLIC DEACTIVATION AND METHODS OF USE BAYLOR UNIVERSITY (US) 2004-06-17 WO disclosed
EP-0068268-A1 Enhancer of anti-tumour effect Yamasa Shoyu Kabushiki Kaisha (JP) 1983-01-05 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-20080070859-A1 Compounds resistant to metabolic deactivation and methods of use NAT1, NNMT, PNP LMNA 2752/4885MTOR 664/4885ALDH1A1 441/4885
US-20120149888-A1 SYNTHESIS OF ARA-2'-O-METHYL-NUCLEOSIDES, CORRESPONDING PHOSPHORAMIDITES AND OLIGONUCLEOTIDES INCORPORATING NOVEL MODIFICATIONS FOR BIOLOGICAL APPLICATION IN THERAPEUCTICS, DIAGNOSTICS, G- TETRAD FORMING OLIGONUCLEOTIDES AND APTAMERS TYMP, MTAP, GART LMNA 2472/4885MTOR 4190/4885ALDH1A1 3050/4885
US-20060122144-A1 Compounds resistant to metabolic deactivation and methods of use NAT1, NNMT, PNP LMNA 2752/4885MTOR 664/4885ALDH1A1 441/4885

“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.