SCHEMBL7536283

SCHEMBL7536283

COC(=O)CCc1cc(OC(C)=O)c(OC)cc1COc1cc(CCC(=O)OC)c(CO[Si](C)(C)C(C)(C)C)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.36
TNFSF11 O14788 1/20 0.36
PDE4D Q08499 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
DRD2 P14416 1/20 0.32
BACE1 P56817 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MTNR1A P48039 3/20 0.31
MTNR1B P49286 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7529985 0.96 TNFSF11 (0.39) HMGCRTNFSF11PDE4DPDE3BPDE3A
SCHEMBL7530218 0.88 HMGCR (0.41) HMGCRPDE4DPDE3BPDE3ADRD2
SCHEMBL7532128 0.86 MTNR1B (0.40) PDE4DMTNR1AMTNR1B
SCHEMBL8959275 0.85 HMGCR (0.41) HMGCRPDE4DBACE1
SCHEMBL7530000 0.83 TNFSF11 (0.41) HMGCRTNFSF11PDE4DPDE3BPDE3A
SCHEMBL7537430 0.83 TNFSF11 (0.41) HMGCRTNFSF11PDE4DPDE3BPDE3A
SCHEMBL7530056 0.83 TNFSF11 (0.41) HMGCRTNFSF11PDE4DPDE3BPDE3A
SCHEMBL7537891 0.82 TNFSF11 (0.40) HMGCRTNFSF11PDE4DPDE3BPDE3A
SCHEMBL7531040 0.82 HMGCR (0.38) HMGCRPDE4DPDE3BPDE3ABACE1
SCHEMBL7530400 0.81 MTNR1A (0.36) HMGCRPDE4DPDE3BPDE3ADRD2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585371-B1 AROMATIC OLIGOMERIC COMPOUNDS USEFUL AS MIMICS OF BIOACTIVE MACROMOLECULES RHONE POULENC RORER INTERNAT H (US) 2002-04-17 EP disclosed
US-5571506-A AROMATIC ALDEHYDE OLIGOMERS FOR TREATMENT OF CARDIOVASCULAR DISORDERS, BONE METABOLISM, ANTILIPEMIC AGENTS AND GASTROINTESTINAL DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-11-05 US disclosed
EP-0585371-A4 AROMATIC OLIGOMERIC COMPOUNDS USEFUL AS MIMICS OF BIOACTIVE MACROMOLECULES RHONE POULENC RORER INT (US) 1994-07-13 EP disclosed
EP-0585371-A1 AROMATIC OLIGOMERIC COMPOUNDS USEFUL AS MIMICS OF BIOACTIVE MACROMOLECULES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1994-03-09 EP disclosed
WO-1992020350-A1 AROMATIC OLIGOMERIC COMPOUNDS USEFUL AS MIMICS OF BIOACTIVE MACROMOLECULES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-11-26 WO disclosed