SCHEMBL6555940

SCHEMBL6555940

Cc1cn([C@H](CCO)OCCO)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYMP P19971 4/20 0.42
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
POLB P06746 1/20 0.39
ADRA1A P35348 1/20 0.39
BLM P54132 1/20 0.39
MAPK1 P28482 1/20 0.38
HPGD P15428 1/20 0.38
TK1 P04183 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL1902451 1.00 TYMP (0.42) TYMPALDH1A1LMNAALBPOLB
SCHEMBL12748530 1.00 TYMP (0.42) TYMPALDH1A1LMNAALBPOLB
SCHEMBL10475695 0.91 TYMP (0.40) TYMPALDH1A1LMNAALBPOLB
SCHEMBL10474572 0.89 TYMP (0.42) TYMPALDH1A1LMNAALBPOLB
SCHEMBL10474754 0.88 TYMP (0.41) TYMPALDH1A1LMNAALBPOLB
SCHEMBL14068557 0.87 TYMP (0.39) TYMPALDH1A1LMNAALBPOLB
SCHEMBL29367079 0.85 TYMP (0.39) TYMPALDH1A1LMNAALBPOLB
SCHEMBL13970114 0.85 TYMP (0.41) TYMPALDH1A1LMNAALBPOLB
SCHEMBL24548479 0.83 TYMP (0.42) TYMPALDH1A1LMNAALBPOLB
SCHEMBL10474801 0.83 SMN1; SMN2 (0.52) TYMPALDH1A1LMNAALBPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2011-08-11 US disclosed
US-20100152126-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2010-06-17 US disclosed
US-20080064655-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B INDENIX PHARMACEUTICALS, INC. (US) 2008-03-13 US disclosed
US-20070087995-A1 beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2007-04-19 US disclosed
EP-0898575-B1 A COMBINATORIAL PROTECTING GROUP STRATEGY FOR MULTIFUNCTIONAL MOLECULES KOESTER HUBERT DR (US) 2004-12-29 EP disclosed
US-6828435-B2 Three blocking groups are independently removable under 3 different conditions; using new protection schemes and solid phase synthesis, oligonucleotides are obtained in 5' to 3' direction using phosphoamidites and avoiding depurination HK PHARMACEUTICALS, INC. 2004-12-07 US disclosed
US-20030194741-A1 COMBINATORIAL PROTECTING GROUP STRATEGY FOR MULTIFUNCTIONAL MOLECULES CAPROTEC BIOANALYTICS GMBH (DE) 2003-10-16 US disclosed
US-20030054410-A1 Combinatorial protecting group strategy for multifunctional molecules CAPROTEC BIOANALYTICS GMBH (DE) 2003-03-20 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 (6 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-20070087995-A1 beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC TYMP 9/4885ALDH1A1 2036/4885LMNA 1188/4885
US-20030194741-A1 COMBINATORIAL PROTECTING GROUP STRATEGY FOR MULTIFUNCTIONAL MOLECULES ADAR, RNMT, ATIC TYMP 144/4885ALDH1A1 4111/4885LMNA 2407/4885
US-20100152126-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC TYMP 9/4885ALDH1A1 2036/4885LMNA 1188/4885
US-20030054410-A1 Combinatorial protecting group strategy for multifunctional molecules ADAR, RNMT, RRM1 TYMP 99/4885ALDH1A1 3683/4885LMNA 2581/4885
US-20080064655-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B ATIC, SLC35B2, AASDHPPT TYMP 34/4885ALDH1A1 2228/4885LMNA 795/4885
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC TYMP 9/4885ALDH1A1 2036/4885LMNA 1188/4885

“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.