SCHEMBL7070022

SCHEMBL7070022

CC[Si](CC)(CC)O[C@H]1[C@@H](OC2CCCCO2)[C@H](Oc2ccc3c(OC(c4ccccc4)c4ccccc4)cc(=O)oc3c2C)OC(C)(C)[C@@H]1OC

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAP1LC3B Q9GZQ8 2/20 0.33
MAP1LC3A Q9H492 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSP90AA1 P07900 4/20 0.33
HSP90AB1 P08238 4/20 0.33
POLQ O75417 1/20 0.33
ALB P02768 1/20 0.33
KDR P35968 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL7070024 1.00 HPGD (0.34) HPGDKDM4EALDH1A1MAPTMEN1
SCHEMBL7195888 0.85 MAP1LC3B (0.42) HPGDKDM4EALDH1A1MAPTMAP1LC3B
SCHEMBL7190073 0.79 KMT2A (0.35) KDM4EMEN1KMT2AMAP1LC3BMAP1LC3A
SCHEMBL6937692 0.79 LMNA (0.42) KDM4EMAP1LC3BMAP1LC3AHSP90AA1HSP90AB1
SCHEMBL6940113 0.79 HSP90AB1 (0.36) KDM4EMAP1LC3BMAP1LC3AHSP90AA1HSP90AB1
SCHEMBL6940108 0.79 HSP90AB1 (0.36) KDM4EMAP1LC3BMAP1LC3AHSP90AA1HSP90AB1
SCHEMBL6937333 0.79 LMNA (0.40) KDM4EMAP1LC3BMAP1LC3AHSP90AA1HSP90AB1
SCHEMBL7193790 0.78 HSP90AB1 (0.36) KDM4EMAP1LC3BMAP1LC3AHSP90AA1HSP90AB1
SCHEMBL6938077 0.76 HSP90AB1 (0.46) HPGDKDM4EALDH1A1MAPTMEN1
SCHEMBL6938071 0.76 HSP90AB1 (0.46) HPGDKDM4EALDH1A1MAPTMEN1

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
US-6579902-B1 Antibiotic; ethoxy-carbamic acid 3'-ester of N-(7-((6-deoxy-5-C-methyl-4-O- methyl-alpha-L-lyxo-hexopyranosyl)oxy)-4-hydroxy-8-methyl-2-oxo-2H-1 -benzopyran-3-yl)-benzeneacetamide AVENTIS PHARMA S.A. (FR) 2003-06-17 US disclosed
EP-1045856-B1 NOVEL AROMATIC AMIDES, PREPARATION METHOD AND APPLICATION AS MEDICINES AVENTIS PHARMA SA (FR) 2003-04-09 EP disclosed