SCHEMBL8434064

SCHEMBL8434064

CC1=Cc2ccccc2C1c1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1C Q14123 1/20 0.50
MAPT P10636 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
HTR2C P28335 5/20 0.47
HTR2A P28223 4/20 0.47
HTR2B P41595 3/20 0.47
ATM Q13315 2/20 0.44
SLC6A4 P31645 1/20 0.43
ADRB2 P07550 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP3 P42574 1/20 0.41
CASP7 P55210 1/20 0.41
PDE4D Q08499 1/20 0.41
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
IDO1 P14902 3/20 0.39
AR P10275 1/20 0.39

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
SCHEMBL5477612 0.73 KDM1A (0.44) MAPTALDH1A1SLC6A4KDM4EIDO1
SCHEMBL27791302 0.73 HTR2C (0.56) PDE1CMAPTALDH1A1GAAHTR2C
SCHEMBL8622033 0.70 HTR2C (0.53) PDE1CMAPTALDH1A1GAAHTR2C
SCHEMBL30008472 0.70 HTR2C (0.53) PDE1CMAPTALDH1A1GAAHTR2C
SCHEMBL21213977 0.69 KDM1A (0.40) ALDH1A1GAAHTR2CHTR2AHTR2B
SCHEMBL7651339 0.69 HSD17B10 (0.39) MAPTALDH1A1ATMSLC6A4MAPK1
SCHEMBL6673270 0.69 GAA (0.35) MAPTGAAHTR2AHTR2BSLC6A4
SCHEMBL20468575 0.67 HTR2C (0.53) PDE1CMAPTALDH1A1GAAHTR2C
SCHEMBL3264451 0.67 ALDH1A1 (0.69) PDE1CMAPTALDH1A1GAAHTR2C
Hydrochloric Acid SCHEMBL7937366 0.67 HSD17B10 (0.37) MAPTALDH1A1ATMSLC6A4MAPK1

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