SCHEMBL3265084

SCHEMBL3265084

O=c1[nH]c(=O)n([C@@H]2CC(O)[C@H](COP(=O)(O)O)O2)cc1O

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 5/20 0.71

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
SCHEMBL3265080 1.00 TYMS (0.71) TYMS
SCHEMBL6462543 0.90 POLB (0.62) TYMS
SCHEMBL149769 0.90 POLB (0.62) TYMS
Thymidine Monophosphate SCHEMBL8366987 0.88 POLB (0.80) TYMS
5-Fluorodeoxyuridylate SCHEMBL21901970 0.88 LMNA (0.71) TYMS
Thymidine Monophosphate SCHEMBL16280929 0.88 POLB (0.80) TYMS
5-Fluorodeoxyuridylate SCHEMBL15189164 0.88 LMNA (0.71) TYMS
Thymidine Monophosphate SCHEMBL3984895 0.88 POLB (0.80) TYMS
5-Fluorodeoxyuridylate SCHEMBL973436 0.88 LMNA (0.71) TYMS
SCHEMBL335865 0.88 TYMS (0.74) TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010022454-A1 METHODS, PRIMERS AND KITS FOR GENOTYPING NEOSPORA SPECIES AND STRAINS UNIVERSITY OF TECHNOLOGY, SYDNEY (AU) 2010-03-04 WO disclosed