SCHEMBL2920844

SCHEMBL2920844

O=c1[nH]c(=O)n([C@H]2CO[C@H](CO)O2)cc1/C=C/I

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
TSHR P16473 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TK2 O00142 5/20 0.47
TYMS P04818 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NT5C Q8TCD5 1/20 0.38
NT5M Q9NPB1 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
SCHEMBL2920229 1.00 TK1 (0.53) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2920850 1.00 TK1 (0.53) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2920226 1.00 TK1 (0.53) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2920233 1.00 TK1 (0.53) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2920223 1.00 TK1 (0.53) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2915114 0.91 TK1 (0.64) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2915121 0.91 TK1 (0.64) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2915125 0.91 TK1 (0.64) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2919241 0.91 TK1 (0.64) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL2919240 0.91 TK1 (0.64) TK1CYP1A2CYP3A4TSHRBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204415-B1 5-(E)-BROMOVINYL URACIL ANALOGUES AND RELATED PYRIMIDINE NUCLEOSIDES AS ANTI-VIRAL AGENTS AND METHODS OF USE UNIV YALE (US) 2010-09-08 EP disclosed
US-6653318-B1 Varicella zoster and epstein barr viruses YALE UNIVERSITY 2003-11-25 US disclosed