SCHEMBL6059308

SCHEMBL6059308

c1ccc(COc2ccc(-c3ccc(OCOc4ccc(-c5ccc(OCc6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
CYP1A2 P05177 1/20 0.64
PTGS1 P23219 1/20 0.64
SLC6A2 P23975 1/20 0.64
CYP2C19 P33261 1/20 0.64
PTGS2 P35354 1/20 0.64
SLC6A3 Q01959 1/20 0.64
HIF1A Q16665 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
GSTP1 P09211 2/20 0.62
MAOB P27338 4/20 0.62
GAA P10253 2/20 0.62
RAB9A P51151 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MAPT P10636 1/20 0.62
MAOA P21397 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
BCHE P06276 1/20 0.58
NR4A1 P22736 1/20 0.56
NR4A2 P43354 1/20 0.56

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
SCHEMBL197017 0.94 LMNA (0.72) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL23483029 0.91 LMNA (0.69) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL1096817 0.91 LMNA (0.69) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL197717 0.88 TSHR (0.56) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL27367676 0.87 LMNA (0.82) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL339813 0.87 LMNA (0.82) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL254671 0.86 LMNA (0.88) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9617467 0.86 LMNA (0.62) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL1703352 0.85 APP (0.69) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL14280087 0.84 LSS (0.53) LMNAHDAC6GSTP1RAB9ASMN1; SMN2

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