SCHEMBL7089134

SCHEMBL7089134

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

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TET2 Q6N021 1/20 0.31
TSHR P16473 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
SCHEMBL7089137 0.85 ALOX15 (0.35) ALDH1A1TET2
SCHEMBL7089850 0.81 MGAM (0.30)
SCHEMBL6276294 0.81 TSHR (0.39) ALDH1A1TET2TSHR
SCHEMBL1066182 0.81 ALDH1A1 (0.32) ALDH1A1TET2TSHR
SCHEMBL8639459 0.78
SCHEMBL678671 0.78 CYP2D6 (0.39) ALDH1A1TET2
SCHEMBL7223189 0.76 CA2 (0.40) ALDH1A1TET2TSHR
SCHEMBL10396148 0.76 TET2 (0.32) ALDH1A1TET2
Fluoride SCHEMBL3612510 0.76 CYP2D6 (0.38) ALDH1A1
SCHEMBL3940721 0.76 ALDH1A1 (0.39) ALDH1A1TET2TSHR

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-1331494-A1 COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PLASTIC LENS NOF CORPORATION (JP) 2003-07-30 EP disclosed