SCHEMBL6259557

SCHEMBL6259557

CC(C)(CO)COC(=O)CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
DGAT1 O75907 1/20 0.33
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32
SERPINE1 P05121 1/20 0.31
TSHR P16473 1/20 0.30
KDM4E B2RXH2 1/20 0.30
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30

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
SCHEMBL13380218 0.89 MGAM (0.44) MGAMGAASIMGAM2DGAT1
SCHEMBL17746187 0.83 MGAM (0.44) MGAMGAASIMGAM2DGAT1
SCHEMBL8700063 0.82 EGLN1 (0.41) DGAT1SERPINE1TSHRKDM4EADRA1A
SCHEMBL8997470 0.81 CYP4F2 (0.32) MGAMGAASIMGAM2SERPINE1
SCHEMBL15892076 0.80 SERPINE1 (0.33) SERPINE1
SCHEMBL21143363 0.80 ADRA2A (0.38) GAASERPINE1TSHRADRA1A
SCHEMBL1247793 0.80 MGAM (0.39) MGAMGAASIMGAM2LDHA
SCHEMBL14000608 0.79 MGAM (0.35) MGAMGAASIMGAM2
SCHEMBL230981 0.79 TSHR (0.44) TSHRFFAR1TDP1
SCHEMBL27853451 0.78 NAAA (0.39) MGAMGAASIMGAM2SERPINE1

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-1359173-B1 Polymerizable solid compositions DAINIPPON INK & CHEMICALS (JP) 2005-07-06 EP disclosed
EP-1359173-A1 Polymerizable solid compositions DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-11-05 EP disclosed