SCHEMBL31233231

SCHEMBL31233231

O=[13C](/C=[13CH]/c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)c1c(O)cc(OCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 1/20 0.66
▸ SLC5A2 P31639 1/20 0.66
▸ KDM4E B2RXH2 3/20 0.60
▸ LMNA P02545 2/20 0.60
▸ PDE4A P27815 1/20 0.60
▸ PDE4B Q07343 1/20 0.60
▸ PDE4C Q08493 1/20 0.60
▸ PDE4D Q08499 1/20 0.60
▸ ALDH1A1 P00352 2/20 0.59
▸ THRB P10828 1/20 0.59
▸ ABCG2 Q9UNQ0 2/20 0.55
▸ APP P05067 4/20 0.54
▸ CYP3A4 P08684 3/20 0.53
▸ MAPT P10636 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ TP53 P04637 2/20 0.53
▸ ATM Q13315 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ AKR1C3 P42330 1/20 0.53
▸ MEN1 O00255 2/20 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
SCHEMBL25223332 1.00 SLC5A1 (0.66) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL30382807 1.00 SLC5A1 (0.66) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL3673937 1.00 SLC5A1 (0.66) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL30383521 1.00 SLC5A1 (0.66) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL25207126 0.92 SLC5A1 (0.65) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL25196269 0.91 PDE4A (0.58) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL30383937 0.91 PDE4A (0.58) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL25196754 0.91 PDE4A (0.58) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL30383214 0.91 PDE4A (0.58) SLC5A1SLC5A2KDM4ELMNAPDE4A
SCHEMBL13657210 0.91 SLC5A1 (0.80) SLC5A1SLC5A2KDM4EPDE4APDE4B

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 — — WO disclosed
Send feedback