SCHEMBL7793526

SCHEMBL7793526

CO[C@@H]1[C@H](OC(=O)NC2CCCC2)[C@H](O)[C@H](c2ccc3c(O)c(C(=O)O)c(=O)oc3c2C)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 2/20 0.36
LMNA P02545 1/20 0.36
MAP1LC3B Q9GZQ8 2/20 0.36
MAP1LC3A Q9H492 2/20 0.36
POLQ O75417 1/20 0.36
ALB P02768 1/20 0.36
HSP90AA1 P07900 1/20 0.36
KDR P35968 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL7793428 0.99 HSP90AB1 (0.37) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL7784171 0.85 LMNA (0.45) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL7793587 0.82 MAP1LC3B (0.38) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL7794162 0.79 TP53 (0.36) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL6866982 0.78 HSP90AB1 (0.49) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL6866985 0.78 HSP90AB1 (0.49) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL6866643 0.78 HSP90AB1 (0.49) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL6866639 0.78 HSP90AB1 (0.49) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL7784151 0.78 LMNA (0.39) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ
SCHEMBL6859895 0.77 HSP90AB1 (0.50) HSP90AB1LMNAMAP1LC3BMAP1LC3APOLQ

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
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