SCHEMBL10017765

SCHEMBL10017765

CC(=O)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)C(OC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ TP53 P04637 1/20 0.64
▸ MAPT P10636 1/20 0.64
▸ TDP1 Q9NUW8 1/20 0.64
▸ PRKAB2 O43741 1/20 0.56
▸ PRKAG1 P54619 1/20 0.56
▸ PRKAA2 P54646 1/20 0.56
▸ PRKAA1 Q13131 1/20 0.56
▸ PRKAG3 Q9UGI9 1/20 0.56
▸ PRKAG2 Q9UGJ0 1/20 0.56
▸ PRKAB1 Q9Y478 1/20 0.56
▸ GSK3A P49840 2/20 0.54
▸ RPS6KA3 P51812 2/20 0.54
▸ MAPK14 Q16539 2/20 0.54
▸ THRB P10828 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ P2RX3 P56373 1/20 0.52
▸ TYMP P19971 4/20 0.49

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
SCHEMBL24191242 1.00 LMNA (0.64) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL10048818 1.00 LMNA (0.64) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL10001659 1.00 LMNA (0.64) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL14943053 1.00 LMNA (0.64) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL3150082 1.00 LMNA (0.64) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL20857280 0.91 ALDH1A1 (0.54) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL7060133 0.91 ALDH1A1 (0.54) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL9658521 0.91 ALDH1A1 (0.54) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL2619734 0.90 ALDH1A1 (0.51) LMNAALDH1A1TP53MAPTTDP1
SCHEMBL13597937 0.90 ALDH1A1 (0.51) LMNAALDH1A1TP53MAPTTDP1

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-8114986-B2 Analogous compounds of 6-thioguanosine triphosphate, their use in medical fields and processes for their preparation GIULIANI INTERNATIONAL LIMITED (IE) 2012-02-14 — — US disclosed
US-7884202-B2 Nucleobases are perfluoroalkylated in a one step process with a perfluoroalkyl halide in the presence of a sulfoxide, a peroxide and an iron compound; useful as medicinal drugs, intermediates for medicinal drugs and agricultural chemicals TOSOH CORPORATION (JP) 2011-02-08 — — US disclosed
US-20100323980-A9 Improvements to analogous compounds of 6-thioguanosine triphosphate, their use in medical fields and processes for their preparation NOGRA PHARMA LIMITED (IE) 2010-12-23 — — US disclosed
US-7855285-B2 Methods for selective N-9 glycosylation of purines BRIGHAM YOUNG UNIVERSITY (US) 2010-12-21 — — US disclosed
US-20090258837-A1 Analogous compounds of 6-thioguanosine triphosphate, their use in medical fields and processes for their preparation GIULIANI INTERNATIONAL LIMITED (IE) 2009-10-15 — — US disclosed
US-20080262214-A1 Synthesis of 2-Substituted Adenosines CAMBRIDGE BIOTECHNOLOGY LIMITED (GB) 2008-10-23 — — US disclosed
US-20080207891-A1 Methods For Selective N-9 Glycosylation of Purines BRIGHAM YOUNG UNIVERSITY (US) 2008-08-28 — — 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 (4 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-20090258837-A1 Analogous compounds of 6-thioguanosine triphosphate, their use in medical fields and processes for their preparation TPMT, MTAP, G6PD LMNA 4630/4885ALDH1A1 1888/4885TP53 2809/4885
US-20080262214-A1 Synthesis of 2-Substituted Adenosines ADORA3, ADORA1, ADORA2A LMNA 1170/4885ALDH1A1 839/4885TP53 4170/4885
US-20080207891-A1 Methods For Selective N-9 Glycosylation of Purines PNP, SLC29A2, SLC28A2 LMNA 2535/4885ALDH1A1 872/4885TP53 3966/4885
US-20100323980-A9 Improvements to analogous compounds of 6-thioguanosine triphosphate, their use in medical fields and processes for their preparation TPMT, G6PD, MTAP LMNA 4616/4885ALDH1A1 1956/4885TP53 3205/4885

“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.

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