SCHEMBL7784152

SCHEMBL7784152

CO[C@@H]1[C@H](O)[C@@H](O)[C@H](c2ccc3c(O)c(C(=O)O)c(=O)oc3c2C)O[C@]1(C)CO

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
HSP90AB1 P08238 3/20 0.34
MAP1LC3B Q9GZQ8 2/20 0.34
MAP1LC3A Q9H492 2/20 0.34
HSP90AA1 P07900 2/20 0.34
POLQ O75417 1/20 0.34
ALB P02768 1/20 0.34
KDR P35968 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
NQO1 P15559 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL7608589 0.93 LMNA (0.36) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6942331 0.92 LMNA (0.37) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7612818 0.90 ALDH1A1 (0.43) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL8381251 0.90 KDM4E (0.39) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7784140 0.89 LMNA (0.33) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7605642 0.88 ALDH1A1 (0.34) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7605603 0.88 LMNA (0.33) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7789599 0.86 LMNA (0.31) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7793587 0.86 MAP1LC3B (0.38) LMNAHSP90AB1MAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7793422 0.86 KDM4E (0.35) HSP90AB1HSP90AA1KDM4E

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-0906326-B1 NOVEL AROMATIC DERIVATIVES SUBSTITUTED BY A RIBOSE, THEIR METHOD OF PREPARATION AND APPLICATION AS MEDICINE AVENTIS PHARMA SA (FR) 2001-11-21 EP claimed
EP-0906326-B1 NOVEL AROMATIC DERIVATIVES SUBSTITUTED BY A RIBOSE, THEIR METHOD OF PREPARATION AND APPLICATION AS MEDICINE AVENTIS PHARMA SA (FR) 2001-11-21 EP disclosed