SCHEMBL8436669

SCHEMBL8436669

CC1=CC(c2ccccc2)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
GPR3 P46089 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
HTR2B P41595 1/20 0.34
GAA P10253 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CACNA1D Q01668 1/20 0.33
ADRA2C P18825 1/20 0.32
PTGS2 P35354 1/20 0.32
HRH1 P35367 1/20 0.32
HTR3A P46098 1/20 0.32
PDE4D Q08499 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL2975608 0.78 MEN1 (0.36) LMNATP53CYP1A2MAPTMAPK1
SCHEMBL2962283 0.78 MAPK1 (0.39) ALDH1A1CYP1A2MAPK1HTR2BCACNA1D
SCHEMBL2973832 0.72 GID4 (0.37) ALDH1A1
SCHEMBL2966774 0.72 ALDH1A1 (0.35) ALDH1A1LMNATP53CYP1A2CYP3A4
SCHEMBL29385315 0.71 GPR3 (0.38) ALDH1A1GPR3LMNATP53CYP1A2
SCHEMBL5356718 0.71 GPR3 (0.38) ALDH1A1GPR3LMNATP53CYP1A2
SCHEMBL5078553 0.71 ALDH1A1 (0.46) ALDH1A1LMNATP53CYP1A2CYP3A4
SCHEMBL7936607 0.71 GPR3 (0.34) GPR3TP53GAAMEN1KMT2A
SCHEMBL31590055 0.71 ALDH1A1 (0.35) ALDH1A1CYP3A4MAPK1
SCHEMBL8729100 0.70

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