SCHEMBL8436665

SCHEMBL8436665

CC1=[C]C(c2ccccc2)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GPR3 P46089 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTR2B P41595 1/20 0.33
ADRA2C P18825 1/20 0.31
PTGS2 P35354 1/20 0.31
HRH1 P35367 1/20 0.31
HTR3A P46098 1/20 0.31
PDE4D Q08499 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 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
SCHEMBL1702917 0.72 GPR3 (0.37) GPR3LMNAMEN1POLBKMT2A
SCHEMBL6345273 0.68 ACHE (0.34) GAAL3MBTL1GPR3CYP1A2MEN1
SCHEMBL1387795 0.62 MAPT (0.39) ALDH1A1GAALMNATP53CYP1A2
SCHEMBL70993 0.61 LMNA (0.54) ALDH1A1L3MBTL1GPR3LMNATP53
SCHEMBL29370508 0.61 LMNA (0.54) ALDH1A1L3MBTL1GPR3LMNATP53
SCHEMBL25171318 0.61 LMNA (0.54) ALDH1A1L3MBTL1GPR3LMNATP53
SCHEMBL8436669 0.61 ALDH1A1 (0.37) ALDH1A1GAAL3MBTL1GPR3LMNA
SCHEMBL9688889 0.61 EDNRA (0.34) ALDH1A1GAALMNACYP1A2CYP3A4
SCHEMBL1028465 0.58 EDNRA (0.32) ALDH1A1EDNRA
SCHEMBL31454004 0.58 ALDH1A1 (0.42) ALDH1A1GPR3LMNATP53CYP1A2

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
US-5942459-A ALUMOXANE-FREE MIXTURE OF TRANSITION METAL METALLOCENE, ORGANOALUMINUM COMPOUND, BORIC ACID-CONTAINING POWDER MITSUBISHI CHEMICAL CORPORATION (JP) 1999-08-24 US claimed
EP-0728773-B1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEM CORP (JP) 1998-11-04 EP claimed
EP-0728773-A1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-28 EP claimed
US-5942459-A ALUMOXANE-FREE MIXTURE OF TRANSITION METAL METALLOCENE, ORGANOALUMINUM COMPOUND, BORIC ACID-CONTAINING POWDER MITSUBISHI CHEMICAL CORPORATION (JP) 1999-08-24 US disclosed
EP-0728773-B1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEM CORP (JP) 1998-11-04 EP disclosed
EP-0728773-A1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-28 EP disclosed