SCHEMBL2591610

SCHEMBL2591610

O=C(O)COc1ccc(Cl)cc1CO.[NaH]

nearest known ligand 0.97

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.97
PTGDR2 Q9Y5Y4 16/20 0.67
PTGDR Q13258 4/20 0.67
TDP1 Q9NUW8 2/20 0.66
TSHR P16473 1/20 0.59
PTGER2 P43116 1/20 0.52

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
SCHEMBL121636 0.98 MAPT (1.00) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL1372961 0.97 MAPT (0.97) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL4628496 0.87 MAPT (0.79) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL21273848 0.85 MAPT (0.77) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL14340636 0.85 MAPT (0.77) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL11113035 0.85 MAPT (0.77) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL11110347 0.84 MAPT (0.74) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL11106300 0.84 MAPT (0.74) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL12830790 0.84 MAPT (0.74) MAPTPTGDR2PTGDRTDP1TSHR
SCHEMBL12463783 0.84 MAPT (0.74) MAPTPTGDR2PTGDRTDP1TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140007297-A1 BRASSICA PLANTS WITH ALTERED ARCHITECTURE BAYER CROPSCIENCE NV (BE) 2014-01-02 US disclosed
EP-2566318-A1 BRASSICA PLANTS WITH ALTERED ARCHITECTURE Bayer CropScience NV (BE) 2013-03-13 EP disclosed
WO-2011137998-A1 BRASSICA PLANTS WITH ALTERED ARCHITECTURE BAYER BIOSCIENCE N.V. (BE) 2011-11-10 WO disclosed