SCHEMBL6519760

SCHEMBL6519760

C=C(CC(=O)OC)C(=O)OCC(=O)CC

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.35
GAA P10253 2/20 0.35
SI P14410 2/20 0.35
MGAM2 Q2M2H8 2/20 0.35
TSHR P16473 3/20 0.33
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TET2 Q6N021 1/20 0.31

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
SCHEMBL6520730 0.91 MGAM (0.37) MGAMGAASIMGAM2TDP1
SCHEMBL6520598 0.87 GAA (0.48) MGAMGAASIMGAM2TSHR
SCHEMBL6521122 0.85 FAAH (0.31) MGAMGAASIMGAM2TSHR
SCHEMBL6516078 0.84 MGAM (0.41) MGAMGAASIMGAM2TSHR
SCHEMBL6518855 0.81 MGAM (0.45) MGAMGAASIMGAM2TSHR
SCHEMBL6523718 0.81 MGAM (0.48) MGAMGAASIMGAM2TSHR
SCHEMBL1597247 0.80 MGAM (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL6524355 0.79 TSHR (0.37) MGAMGAASIMGAM2TSHR
SCHEMBL20629621 0.79 TSHR (0.37) MGAMGAASIMGAM2TSHR
SCHEMBL6518898 0.77 NAAA (0.42) TSHRALDH1A1HSD17B10

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
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed