SCHEMBL8995414

SCHEMBL8995414

CC#Cc1c([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
UMPS P11172 1/20 0.36
PYGL P06737 3/20 0.35
PNP P00491 3/20 0.35
TNF P01375 1/20 0.34
IL6 P05231 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
SLC5A2 P31639 1/20 0.34

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
SCHEMBL30751087 0.79 SLC5A2 (0.40) UMPSPYGLSLC5A2
SCHEMBL29286002 0.77 UMPS (0.42) UMPSPYGLPNPLMNA
SCHEMBL10873399 0.77 UMPS (0.39) UMPSPYGLPNPLMNATSHR
SCHEMBL31565646 0.77 PYGM (0.41) UMPSPYGLPNPLMNA
SCHEMBL10873403 0.77 UMPS (0.39) UMPSPYGLPNPLMNATSHR
SCHEMBL29510865 0.76 UMPS (0.39) UMPSPYGLPNPSLC5A2
SCHEMBL29423327 0.76 UMPS (0.39) UMPSPYGLPNPSLC5A2
SCHEMBL31357478 0.75 UMPS (0.38) UMPSPYGLPNPLMNATSHR
SCHEMBL30295619 0.72 TK2 (0.45) UMPSPYGLPNPTSHR
SCHEMBL30295613 0.72 TK2 (0.45) UMPSPYGLPNPTSHR

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-0726904-A1 5-FLUOROURACIL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1996-08-21 EP disclosed
WO-1995012606-A1 5-FLUOROURACIL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1995-05-11 WO disclosed