SCHEMBL8378176

SCHEMBL8378176

O=C(CCc1ccc2occc2c1)c1c(O)cccc1O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 13/20 0.73
▸ SLC5A2 P31639 9/20 0.73
▸ ALDH1A1 P00352 2/20 0.54
▸ SLC28A3 Q9HAS3 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ SLC28A2 O43868 1/20 0.53
▸ EPHX2 P34913 1/20 0.53

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
SCHEMBL8378175 1.00 SLC5A1 (0.73) SLC5A1SLC5A2ALDH1A1SLC28A3HPGD
SCHEMBL8369261 0.94 SLC5A1 (0.81) SLC5A1SLC5A2SLC28A3HPGDHSD17B10
SCHEMBL8368371 0.88 SLC5A1 (0.65) SLC5A1SLC5A2ALDH1A1SLC28A3HPGD
SCHEMBL8367167 0.88 SLC5A1 (0.67) SLC5A1SLC5A2ALDH1A1SLC28A3HPGD
SCHEMBL8382096 0.85 SLC5A1 (0.64) SLC5A1SLC5A2ALDH1A1SLC28A3HPGD
SCHEMBL8382094 0.85 SLC5A1 (0.64) SLC5A1SLC5A2ALDH1A1SLC28A3HPGD
SCHEMBL8369287 0.85 SLC5A1 (0.65) SLC5A1SLC5A2SLC28A3HPGDHSD17B10
SCHEMBL14104531 0.85 SLC5A1 (1.00) SLC5A1SLC5A2SLC28A3HPGDHSD17B10
SCHEMBL6724534 0.85 SLC5A1 (0.66) SLC5A1SLC5A2SLC28A3HPGDHSD17B10
SCHEMBL6725644 0.85 SLC5A1 (1.00) SLC5A1SLC5A2SLC28A3HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0684254-B1 Propiophenone derivative and a process for preparing the same TANABE SEIYAKU CO (JP) 1999-03-24 — — EP disclosed
EP-0684254-A1 Propiophenone derivative and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1995-11-29 — — EP disclosed
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