SCHEMBL18306889

SCHEMBL18306889

O=C(O[C@H]1COC2C1OC[C@H]2OC(=O)c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 17/20 0.66
▸ PTPN1 P18031 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44

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
SCHEMBL12702984 1.00 BCHE (0.66) BCHEPTPN1HSP90AA1CA12CA1
SCHEMBL9946847 1.00 BCHE (0.66) BCHEPTPN1HSP90AA1CA12CA1
SCHEMBL12411417 1.00 BCHE (0.66) BCHEPTPN1HSP90AA1CA12CA1
SCHEMBL7530640 1.00 BCHE (0.66) BCHEPTPN1HSP90AA1CA12CA1
SCHEMBL13367641 1.00 BCHE (0.66) BCHEPTPN1HSP90AA1CA12CA1
SCHEMBL12411448 0.95 BCHE (0.62) BCHEPTPN1HSP90AA1
SCHEMBL12411488 0.92 BCHE (0.59) BCHEPTPN1HSP90AA1
SCHEMBL12942000 0.92 BCHE (0.59) BCHEPTPN1HSP90AA1
SCHEMBL12411490 0.92 BCHE (0.59) BCHEPTPN1HSP90AA1
SCHEMBL14877911 0.92 BCHE (0.59) BCHEPTPN1HSP90AA1

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-2098544-B1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS ADEKA CORP (JP) 2016-12-14 — — EP disclosed
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