SCHEMBL13451925

SCHEMBL13451925

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

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
THRB P10828 1/20 0.33
PRKCA P17252 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL13700498 0.83 TSHR (0.46) TSHRTHRB
SCHEMBL13700520 0.83 TSHR (0.42) TSHRTHRB
SCHEMBL13114803 0.78 TSHR (0.53) TSHRTHRBALDH1A1
SCHEMBL13447899 0.78 TSHR (0.46) TSHRTHRBALDH1A1
SCHEMBL13447952 0.76 TSHR (0.49) TSHRTHRB
SCHEMBL13114887 0.76 TSHR (0.45) TSHRTHRB
SCHEMBL23493794 0.76 TSHR (0.64) TSHRTHRBALDH1A1
SCHEMBL12156906 0.75 TSHR (0.47) TSHR
SCHEMBL94906 0.75 TSHR (0.68) TSHRTHRBALDH1A1
SCHEMBL12163040 0.74 TSHR (0.62) TSHRTHRBALDH1A1

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-2165830-A1 Lithographic printing plate precursor and printing method using the same Fujifilm Corporation (JP) 2010-03-24 EP disclosed