SCHEMBL6059624

SCHEMBL6059624

Oc1ccc(-c2ccc(OCOc3ccc(-c4ccc(O)cc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 4/20 0.56
ESR1 P03372 4/20 0.55
LTA4H P09960 4/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
APP P05067 1/20 0.47
NR5A1 Q13285 1/20 0.47
MMP3 P08254 2/20 0.46
BCL2L1 Q07817 1/20 0.46
ABL1 P00519 2/20 0.45
ABCB1 P08183 2/20 0.45

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
SCHEMBL8452874 0.92 LTA4H (0.56) ESR2ESR1LTA4HLMNACYP1A2
SCHEMBL3418462 0.87 ESR2 (0.59) ESR2ESR1LTA4HLMNACYP1A2
SCHEMBL14218326 0.83 ESR2 (0.54) ESR2ESR1LTA4HLMNACYP1A2
SCHEMBL28279511 0.81 LTA4H (0.64) ESR2LTA4HMEN1KMT2AAPP
SCHEMBL5633288 0.81 APP (0.70) ESR2ESR1LMNACYP1A2PTGS1
SCHEMBL2924048 0.81 ALDH1A1 (0.58) ESR2ESR1LTA4HAPPNR5A1
SCHEMBL22596639 0.81 APP (0.70) ESR2ESR1LMNACYP1A2PTGS1
SCHEMBL7448357 0.81 LTA4H (0.76) ESR2ESR1LTA4HNR5A1
SCHEMBL4354892 0.79 APP (0.61) ESR2ESR1LTA4HLMNACYP1A2
SCHEMBL17676808 0.78 IDO1 (0.50) ESR2ESR1LTA4HLMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125951-B2 Monomers containing at least one biaryl unit and polymers and derivatives prepared therefrom SOUTH DAKOTA SCHOOL OF MINES AND TECHNOLOGY (US) 2006-10-24 US disclosed
US-20040254327-A1 Monomers containing at least one biaryl unit and polymers and derivatives prepared therefrom SOUTH DAKOTA SCHOOL OF MINES AND TECHNOLOGY 2004-12-16 US disclosed
WO-2004037879-A2 MONOMERS CONTAINING AT LEAST ONE BIARYL UNIT AND POLYMERS AND DERIVATIVES PREPARED THEREFROM SOUTH DAKOTA SCHOOL OF MINES AND TECHNOLOGY (US) 2004-05-06 WO disclosed