SCHEMBL6943889

SCHEMBL6943889

CO[C@@H]1[C@@H](O)[C@@H](OC2CCCCO2)[C@H](Oc2ccc3c(O)c(C(=O)O)c(=O)oc3c2C)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 3/20 0.43
LMNA P02545 1/20 0.42
MAP1LC3B Q9GZQ8 2/20 0.42
MAP1LC3A Q9H492 2/20 0.42
HSP90AA1 P07900 2/20 0.42
POLQ O75417 1/20 0.42
ALB P02768 1/20 0.42
KDR P35968 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42

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
SCHEMBL6943894 1.00 HSP90AB1 (0.43) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6941760 0.94 LMNA (0.44) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6940657 0.94 LMNA (0.44) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7075739 0.93 LMNA (0.45) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL7074596 0.93 LMNA (0.45) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6864423 0.91 HSP90AB1 (0.42) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6864422 0.91 HSP90AB1 (0.42) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6860194 0.90 LMNA (0.41) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6860198 0.90 LMNA (0.41) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1
SCHEMBL6939405 0.90 LMNA (0.41) HSP90AB1LMNAMAP1LC3BMAP1LC3AHSP90AA1

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-1045856-B1 NOVEL AROMATIC AMIDES, PREPARATION METHOD AND APPLICATION AS MEDICINES AVENTIS PHARMA SA (FR) 2003-04-09 EP disclosed
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