SCHEMBL13660340

SCHEMBL13660340

C=C(COCCOC(=O)CC(C)=O)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
THRB P10828 1/20 0.40
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.32
CES2 O00748 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
SCHEMBL11918225 0.98 MGAM (0.39) MGAMGAASIMGAM2THRB
SCHEMBL12394947 0.98 MGAM (0.39) MGAMGAASIMGAM2THRB
SCHEMBL12394948 0.87 THRB (0.45) MGAMGAASIMGAM2THRB
SCHEMBL16352656 0.85 MGAM (0.38) MGAMGAASIMGAM2THRB
SCHEMBL1228575 0.82 MGAM (0.41) MGAMGAASIMGAM2THRB
SCHEMBL10248991 0.82 THRB (0.34) MGAMGAASIMGAM2THRB
SCHEMBL10252117 0.82 THRB (0.34) MGAMGAASIMGAM2THRB
SCHEMBL16364749 0.82 THRB (0.34) MGAMGAASIMGAM2THRB
SCHEMBL27993988 0.81 MGAM (0.45) MGAMGAASIMGAM2THRB
SCHEMBL824137 0.79 TDP1 (0.38) THRBALDH1A1TSHR

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
EP-2107422-A1 Method for preparing lithographic printing plate FUJIFILM Corporation (JP) 2009-10-07 EP disclosed