SCHEMBL25190860

SCHEMBL25190860

COCOc1ccc(/C=C/C(=O)c2c(O)cccc2OCc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.61
SLC5A2 P31639 1/20 0.61
APP P05067 1/20 0.57
NFKB1 P19838 7/20 0.56
NFKB2 Q00653 7/20 0.56
RELA Q04206 7/20 0.56
MAOB P27338 2/20 0.55
ABCG2 Q9UNQ0 1/20 0.55
GSK3B P49841 2/20 0.51
BACE1 P56817 2/20 0.51
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL16150086 0.91 SLC5A1 (0.72) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL16150089 0.91 SLC5A1 (0.72) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL25201621 0.90 MAOB (0.65) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL25223424 0.87 NFKB1 (0.69) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL25283130 0.87 NFKB1 (0.69) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL1728134 0.87 NFKB1 (0.65) SLC5A1SLC5A2NFKB1NFKB2RELA
SCHEMBL1728137 0.87 NFKB1 (0.65) SLC5A1SLC5A2NFKB1NFKB2RELA
SCHEMBL25235778 0.87 SLC5A1 (0.69) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL1728221 0.86 NFKB1 (0.61) SLC5A1SLC5A2APPNFKB1NFKB2
SCHEMBL1728224 0.86 NFKB1 (0.61) SLC5A1SLC5A2APPNFKB1NFKB2

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 WO disclosed
EP-4429763-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS Yewsavin, Inc. (US) 2024-09-18 EP disclosed
WO-2023086388-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2023-05-19 WO disclosed