Benzene

Benzene

SCHEMBL27625550

Oc1ccc2ccccc2n1.c1ccccc1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.54
NCF1 P14598 3/20 0.50
NOS2 P35228 1/20 0.50
BACE1 P56817 1/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
CYP1A2 P05177 1/20 0.50
AR P10275 1/20 0.50
KDM4E B2RXH2 4/20 0.48
PRNP P04156 2/20 0.48
RXFP1 Q9HBX9 2/20 0.48
CNR2 P34972 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
ACHE P22303 1/20 0.46
MAPK10 P53779 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 3/20 0.46

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
SCHEMBL84064 0.97 NCF1 (0.52) MGAMNCF1NOS2BACE1CA12
SCHEMBL29376435 0.97 NCF1 (0.52) MGAMNCF1NOS2BACE1CA12
SCHEMBL6140328 0.97 NCF1 (0.52) MGAMNCF1NOS2BACE1CA12
SCHEMBL2478552 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
SCHEMBL11208328 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
Potassium SCHEMBL5616117 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
SCHEMBL23198380 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
SCHEMBL8622817 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
SCHEMBL21545979 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12
Methane SCHEMBL21724933 0.95 NCF1 (0.50) MGAMNCF1NOS2BACE1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100481180-C Image display device and driving method thereof KYOCERA CORP (JP) 2009-04-22 CN disclosed
CN-100406516-C Complex composition, polymer complex compound, and polymeric luminescent element SUMITOMO CHEMICAL CO (JP) 2008-07-30 CN disclosed
CN-1957388-A Image display device and driving method thereof KYOCERA CORP (JP) 2007-05-02 CN disclosed
CN-1764693-A Complex composition, polymer complex compound, and polymeric luminescent element SUMITOMO CHEMICAL CO (JP) 2006-04-26 CN disclosed