SCHEMBL7585030

SCHEMBL7585030

CC(=O)Oc1cc(C)cc(O[C@@H]2O[C@@H]3COC(c4ccccc4)O[C@H]3[C@H](O)[C@H]2O)c1C(=O)CCc1ccc2occc2c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 14/20 0.56
▸ SLC5A1 P13866 13/20 0.56
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7582383 0.93 SLC5A2 (0.55) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL7584461 0.92 SLC5A2 (0.67) SLC5A2SLC5A1MEN1KMT2APTPN1
SCHEMBL7587290 0.90 SLC5A2 (0.48) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL8367171 0.88 SLC5A1 (0.56) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL8368434 0.85 SLC5A2 (0.42) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL7583685 0.84 SLC5A2 (0.56) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL7583594 0.83 SLC5A2 (0.50) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL7585158 0.81 SLC5A2 (0.44) SLC5A2SLC5A1MEN1KMT2AL3MBTL1
SCHEMBL7582187 0.81 SLC5A1 (0.83) SLC5A2SLC5A1
SCHEMBL8370242 0.80 SLC5A1 (0.47) SLC5A2SLC5A1MEN1KMT2AL3MBTL1

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
EP-0850948-B1 Propiophenone derivatives and process for preparing the same TANABE SEIYAKU CO (JP) 2002-04-24 — — EP disclosed
US-6048842-A ANTIDIABETIC AGENT TANABE SEIYAKU CO., LTD. (JP) 2000-04-11 — — US disclosed
EP-0850948-A1 Propiophenone derivatives and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1998-07-01 — — EP disclosed
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