SCHEMBL7267293

SCHEMBL7267293

Cc1cc(C)c(-c2ccc(-c3cccc4cc5ccccc5cc34)cc2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.46
CYP2A6 P11509 1/20 0.46
TLR8 Q9NR97 1/20 0.40
PSMB5 P28074 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
ENPP1 P22413 2/20 0.37
ENPP3 O14638 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
CES1 P23141 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL7055518 0.84 MEN1 (0.45) CYP1A2CYP2A6TLR8ALDH1A1HPGD
SCHEMBL28795643 0.83 MEN1 (0.44) CYP1A2CYP2A6TLR8ALDH1A1HPGD
SCHEMBL537003 0.82 ALDH1A1 (0.44) TLR8ALDH1A1HPGDHSD17B10HSD17B1
SCHEMBL7261308 0.81 CYP1A2 (0.59) CYP1A2CYP2A6PSMB5ALDH1A1HPGD
SCHEMBL27558874 0.81 CYP1A2 (0.44) CYP1A2CYP2A6TLR8ALDH1A1HPGD
SCHEMBL28596457 0.81 NUDT1 (0.40) CYP1A2CYP2A6TLR8PSMB5ALDH1A1
SCHEMBL27667864 0.80 CYP1A2 (0.52) CYP1A2CYP2A6TLR8ALDH1A1HPGD
SCHEMBL28341419 0.79 GSTP1 (0.52) CYP1A2TLR8ALDH1A1HPGDHSD17B10
SCHEMBL27675918 0.78 TNF (0.47) CYP1A2ALDH1A1HPGDHSD17B10HSD17B1
SCHEMBL28606956 0.78 ESR1 (0.50) ALDH1A1HPGDHSD17B1HSD17B2ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6649284-B2 A blue EL element with high emission efficiency, low operatng voltage; a 9-((R-substituted)n-phenyl)anthracene where the R is t-butyl or aryl or heterocyclic to provide steric hindrance to prevent crystallization; transformers; filters INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2003-11-18 US disclosed
US-20020192497-A1 Electroluminance device INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2002-12-19 US disclosed