SCHEMBL13428703

SCHEMBL13428703

NC(C(=O)O)C1OC[C@H](O)[C@H]1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.39
GRM3 Q14832 2/20 0.39
SLC1A2 P43004 3/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP2C9 P11712 1/20 0.35
GRM8 O00222 1/20 0.35
GRM6 O15303 1/20 0.35
APEX1 P27695 1/20 0.35
GRM5 P41594 1/20 0.35
PMP22 Q01453 1/20 0.35
GRM1 Q13255 1/20 0.35
GRM4 Q14833 1/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
SLC1A1 P43005 2/20 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
SCHEMBL10831643 0.78 IDUA (0.44) LMNATDP1
SCHEMBL14875876 0.78 IDUA (0.44) LMNATDP1
SCHEMBL11896565 0.78 IDUA (0.44) LMNATDP1
SCHEMBL10832395 0.78 IDUA (0.44) LMNATDP1
SCHEMBL17509637 0.72 THRB (0.35) LMNA
SCHEMBL21342535 0.72 TDP1 (0.33) LMNATDP1
SCHEMBL28266037 0.70 THRB (0.36) LMNA
SCHEMBL17509641 0.69 THRB (0.32) LMNA
SCHEMBL7620028 0.69 THRB (0.39) LMNA
SCHEMBL13259760 0.69 THRB (0.39) LMNA

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-2010045584-A1 FOLATE TARGETING OF NUCLEOTIDES ENDOCYTE, INC. (US) 2010-04-22 WO disclosed