SCHEMBL12780481

SCHEMBL12780481

C/C=C\C(=O)/C=C(/C)C=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL4015328 0.75
SCHEMBL6058385 0.75
SCHEMBL11960235 0.75 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL28874243 0.74 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL6689061 0.74
SCHEMBL6689066 0.74
SCHEMBL8580176 0.72
SCHEMBL14599339 0.71
SCHEMBL2589699 0.71
SCHEMBL182830 0.71

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-2311894-A1 POLYMER, MATERIAL FOR LUMINESCENT LAYER, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT, SOLAR CELL ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING UTILIZING SAME Mitsubishi Chemical Corporation (JP) 2011-04-20 EP disclosed