SCHEMBL7002818

SCHEMBL7002818

CC(C)C[Al](Oc1cccc(-c2ccccc2)c1-c1ccccc1)Oc1cccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 6/20 0.36
HTR7 P34969 1/20 0.36
MAPK1 P28482 2/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
TP53 P04637 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
ADRA2A P08913 5/20 0.33
ADRA2B P18089 5/20 0.33
ADRA2C P18825 5/20 0.33
PKM P14618 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33

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
SCHEMBL11197784 0.87 HTR7 (0.42) ADRB2HTR7MAPK1LMNAUSP2
SCHEMBL7735423 0.81 ADRA2A (0.38) ADRB2HTR7MAPK1LMNAUSP2
SCHEMBL11116087 0.74 HTR7 (0.42) ADRB2HTR7MAPK1LMNAUSP2
SCHEMBL1561072 0.71 ADRA2A (0.38) ADRB2HTR7MAPK1LMNAUSP2
SCHEMBL895721 0.71 FGFR1 (0.49) HTR7LMNAUSP2MAPTHTT
SCHEMBL30673426 0.70 NCOA1 (0.46) ADRB2HTR7MAPK1LMNAMAPT
SCHEMBL8602820 0.70 NCOA1 (0.46) ADRB2HTR7MAPK1LMNAMAPT
SCHEMBL29290124 0.70 ALDH1A1 (0.49) ADRB2HTR7MAPK1MAPTTP53
SCHEMBL28643270 0.69 ADRA2A (0.38) ADRB2HTR7MAPK1LMNAUSP2
SCHEMBL13685212 0.68 MAPK1 (0.44) ADRB2HTR7MAPK1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714902-B1 Rhenium and aluminium compounds, their preparation and their use as catalysts INST FRANCAIS DU PETROLE (FR) 2003-04-16 EP disclosed
EP-0885656-B1 Catalytic composition and ethylene oligomerization, especially in 1-butene and/or 1-hexene INST FRANCAIS DU PETROLE (FR) 2002-01-02 EP disclosed
EP-0710638-B1 Rhenium and aluminium containing catalytic compositions, their preparation and use for the metathesis of olefins INST FRANCAIS DU PETROLE (FR) 1999-02-10 EP disclosed
EP-0885656-A1 Catalytic composition and ethylene oligomerization, especially in 1-butene and/or 1-hexene Institut Français du Pétrole (FR) 1998-12-23 EP disclosed
EP-0714902-A2 Rhenium and aluminium compounds, their preparation and their use as catalysts INSTITUT FRANCAIS DU PETROLE (FR) 1996-06-05 EP disclosed
EP-0710638-A1 Rhenium and aluminium containing catalytic compositions, their preparation and use for the metathesis of olefins INSTITUT FRANCAIS DU PETROLE (FR) 1996-05-08 EP disclosed