SCHEMBL7533057

SCHEMBL7533057

COC(=O)CCc1ccc(OC)c(OCc2cc(OC)c(OCc3cc(OC)c(OCc4cc(OC)c(OCc5cc(OC)ccc5CCC(=O)OC)cc4CCC(=O)OC)cc3CCC(=O)OC)cc2CCC(=O)OC)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
MTNR1B P49286 4/20 0.47
MAPT P10636 4/20 0.47
MTNR1A P48039 3/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.45
ABCB1 P08183 1/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
FFAR4 Q5NUL3 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
SCHEMBL7532062 0.90 FFAR1 (0.54) KMT2AMEN1MTNR1BMTNR1AFFAR4
SCHEMBL7529980 0.88 POLB (0.43) MTNR1BMTNR1A
SCHEMBL7532476 0.87 ALOX5 (0.50) KMT2AMEN1GAAFFAR4
SCHEMBL7535383 0.87 MTNR1B (0.42) KMT2AMEN1MTNR1BMTNR1A
SCHEMBL7530786 0.86 LTA4H (0.45) KMT2AMEN1MTNR1BMTNR1AFFAR4
SCHEMBL7532128 0.81 MTNR1B (0.40) KMT2AMEN1MTNR1BMTNR1ALMNA
SCHEMBL3940302 0.79 KMT2A (0.59) KMT2AMEN1MAPTALDH1A1
SCHEMBL7535390 0.78 POLB (0.39) KMT2AMEN1MTNR1BMTNR1A
SCHEMBL64208 0.77 MTNR1A (0.61) KMT2AMEN1MTNR1BMTNR1A
SCHEMBL21494459 0.76 PDE4D (0.59) KMT2AMEN1LMNA

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