SCHEMBL10041196

SCHEMBL10041196

Cc1cn([C@@H]2C3O[C@H](CO)C(O)C32)c(=O)[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
ALB P02768 1/20 0.53
POLB P06746 1/20 0.53
ADRA1A P35348 1/20 0.53
BLM P54132 1/20 0.53
TYMP P19971 5/20 0.52
TK2 O00142 2/20 0.50
TK1 P04183 2/20 0.50

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
SCHEMBL19263964 1.00 ALDH1A1 (0.53) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL20067725 1.00 ALDH1A1 (0.53) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL20154819 0.86 LMNA (0.56) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL24797925 0.84 ALB (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL20149724 0.81 LMNA (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL25141270 0.81 TK1 (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL24798285 0.81 TK1 (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL453142 0.81 PYGM (0.70) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL22143517 0.81 PYGM (0.70) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL10812613 0.81 PYGM (0.70) ALDH1A1LMNAALBPOLBADRA1A

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-2012009666-A2 SYNTHESIS OF 2'-DEOXY-2'-[18F]FLUORO-5-METHYL-1-B-D-ARABINOFURANOSYLURACIL (18F-FMAU) UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2012-01-19 WO disclosed