SCHEMBL8922422

SCHEMBL8922422

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

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TK2 O00142 2/20 0.47
PYGM P11217 3/20 0.47
LMNA P02545 1/20 0.47
ALB P02768 1/20 0.47
POLB P06746 1/20 0.47
ADRA1A P35348 1/20 0.47
BLM P54132 1/20 0.47
TK1 P04183 1/20 0.45

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
SCHEMBL8922939 1.00 ALDH1A1 (0.48) ALDH1A1NPSR1TK2PYGMLMNA
SCHEMBL10569281 0.90 ALDH1A1 (0.51) ALDH1A1NPSR1LMNAALBPOLB
SCHEMBL8922794 0.81 ALDH1A1 (0.51) ALDH1A1NPSR1TK2LMNAADRA1A
SCHEMBL12103839 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB
SCHEMBL20154819 0.78 LMNA (0.56) ALDH1A1TK2LMNAALBPOLB
SCHEMBL10812613 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB
SCHEMBL10815567 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB
SCHEMBL2583974 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB
SCHEMBL22143517 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB
SCHEMBL1983444 0.78 PYGM (0.70) ALDH1A1TK2PYGMLMNAALB

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
US-5703224-A Antiviral c-nucleoside derivatives NIPPON SHINYAKU CO. LTD. (JP) 1997-12-30 US disclosed
EP-0733630-A1 NUCLEOSIDE DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1996-09-25 EP disclosed