SCHEMBL10757124

SCHEMBL10757124

Cc1cn(C2C(O)C(O)C(CO)C2F)c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
ALB P02768 1/20 0.49
POLB P06746 1/20 0.49
ADRA1A P35348 1/20 0.49
BLM P54132 1/20 0.49
TK1 P04183 3/20 0.44
TYMP P19971 1/20 0.41
TK2 O00142 1/20 0.40

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
SCHEMBL9025958 0.88 LMNA (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL9024558 0.88 LMNA (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL10746824 0.88 ALDH1A1 (0.52) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL10748623 0.85 LMNA (0.49) LMNA
SCHEMBL10827402 0.84 PYGM (0.52) TK1TK2
SCHEMBL10827403 0.84 PYGM (0.52) TK1TK2
SCHEMBL10827758 0.84 PYGM (0.52) TK1TK2
SCHEMBL10827405 0.84 PYGM (0.52) TK1TK2
SCHEMBL10827761 0.84 PYGM (0.52) TK1TK2
SCHEMBL9309840 0.83 LMNA (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4704392-A VIRICIDES SYNTEX (U.S.A.) INC. (US) 1987-11-03 US disclosed
US-4605659-A HERPES; HEPATITUS SYNTEX (U.S.A.) INC. (US) 1986-08-12 US disclosed