SCHEMBL9965252

SCHEMBL9965252

Cc1cc(O)cc(C)c1-c1c2ccccc2c(-c2c(C)cc(-c3cccc4ccccc34)cc2C)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.49
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
MPI P34949 1/20 0.44
KMT2A Q03164 1/20 0.44
MCL1 Q07820 1/20 0.42
ACMSD Q8TDX5 1/20 0.42
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CYP2A6 P11509 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39
CHRNA1 P02708 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
SCHEMBL9965282 0.84 CA12 (0.41) TLR8ALDH1A1HPGDMCL1ACMSD
SCHEMBL15258011 0.84 CA12 (0.41) TLR8ALDH1A1HPGDMCL1ACMSD
SCHEMBL9965281 0.82 MAPT (0.44) TLR8ALDH1A1MEN1MAPTKMT2A
SCHEMBL30719629 0.82 PTGS1 (0.53) TLR8ALDH1A1KDM4EMEN1MAPT
SCHEMBL17500095 0.82 PTGS1 (0.53) TLR8ALDH1A1KDM4EMEN1MAPT
SCHEMBL7523687 0.79 ABL1 (0.55) TLR8ALDH1A1KDM4EMEN1MAPT
SCHEMBL3357709 0.79 ALDH1A1 (0.47) TLR8ALDH1A1KDM4EMEN1MAPT
SCHEMBL9965264 0.78 NQO2 (0.50) ALDH1A1KDM4EMEN1MAPTHPGD
SCHEMBL28167268 0.78 ALDH1A1 (0.50) TLR8ALDH1A1HPGDMCL1ACMSD
SCHEMBL22078735 0.76 TLR8 (0.74) TLR8MCL1ACMSDCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130240869-A1 ANTHRACENE DERIVATIVE COMPOUNDS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY 2013-09-19 US disclosed
US-20130240869-A1 ANTHRACENE DERIVATIVE COMPOUNDS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY 2013-09-19 US disclosed
WO-2012083300-A1 ANTHRACENE DERIVATIVE COMPOUNDS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-21 WO disclosed