Benzo[Def]Chrysene

Benzo[Def]Chrysene

SCHEMBL5135124

Oc1ccccc1.c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34

nearest known ligand 0.79

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.79
FYN P06241 2/20 0.79
ACHE P22303 2/20 0.79
AHR P35869 2/20 0.79
ERBB2 P04626 1/20 0.79
MAOA P21397 1/20 0.79
ALDH1A1 P00352 8/20 0.52
HSD17B10 Q99714 6/20 0.52
HPGD P15428 6/20 0.52
THRB P10828 1/20 0.52
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
HIF1A Q16665 2/20 0.43
TSHR P16473 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
TRPM4 Q8TD43 1/20 0.42
CYP1B1 Q16678 1/20 0.42
CYP3A4 P08684 2/20 0.41

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
Benzo[Def]Chrysene SCHEMBL24019 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL29352452 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL29407951 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL29826740 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL17114373 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL23414475 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL30358490 0.89 CYP1A2 (1.00) CYP1A2FYNACHEAHRERBB2
SCHEMBL3345624 0.87 CYP1A2 (0.74) CYP1A2FYNACHEAHRERBB2
SCHEMBL4852478 0.87 CYP1A2 (0.96) CYP1A2FYNACHEAHRERBB2
Benzo[Def]Chrysene SCHEMBL5473588 0.87 CYP1A2 (0.96) CYP1A2FYNACHEAHRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3287136-A1 COMPOSITION FOR PREVENTING OR TREATING CELL DAMAGE INCLUDING YOUNGIA DENTICULATA EXTRACT Incospharm Corporation (KR) 2018-02-28 EP disclosed
US-20180050225-A1 COMPOSITION FOR PREVENTING OR TREATING CELL DAMAGE INCLUDING YOUNGIA DENTICULATA EXTRACT INCOSPHARM CORPORATION (KR) 2018-02-22 US disclosed
EP-1537896-B1 Compound mixtures based on sulphur containing amino acids, antioxidants, phospholipids and vitamins for the preparation of a medicament for treating L-diabetes and/or associated diseases. LIEBEL FRANZ-PETER DR (DE) 2008-04-02 EP disclosed
EP-1537896-A1 Compound mixtures based on sulphur containing amino acids, antioxidants, phospholipids and vitamins for the preparation of a medicament for treating L-diabetes and/or associated diseases. Liebel, Franz-Peter, Dr. (DE) 2005-06-08 EP disclosed
US-4260705-A HALOMETHYL GROUP BONDED TO AMINE WITH HYDROPHILIC GROUP BOARD OF REGENTS, FOR AND ON BEHALF OF THE UNIVERSITY OF FLORIDA (US) 1981-04-07 US disclosed
US-4213860-A Affinity chromatography and substrate useful therefor University of Florida, Board of Regents, State of Florida for and on behalf of the (US) 1980-07-22 US disclosed
US-4212905-A AND A VINYL COMPOUND HAVING PENDANT HALO-METHYL GROUPS HAVING AN AMINE LIGAND BOUND THERETO Board of Reagents, for and on behalf of the University of Florida (US) 1980-07-15 US disclosed
US-4162355-A COPOLYCARBONS, IMMOBILIZATION BOARD OF REGENTS, FOR AND ON BEHALF OF THE UNIVERSITY OF FLORIDA (US) 1979-07-24 US disclosed