SCHEMBL4746260

SCHEMBL4746260

c1ccc(-c2c3c(c(-c4ccccc4)c4cnccc24)-c2ccc(-c4cc5c6cccc7c6c(cc5c5ccccc45)-c4ncccc4-7)c4cccc-3c24)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.34
IKBKE Q14164 1/20 0.34
TBK1 Q9UHD2 1/20 0.34
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 1/20 0.34
TOP2A P11388 1/20 0.32
FEN1 P39748 1/20 0.31
PIM1 P11309 1/20 0.31
FLT3 P36888 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
CYP17A1 P05093 1/20 0.30
CYP1A2 P05177 1/20 0.30
ALOX5 P09917 1/20 0.30
TDO2 P48775 1/20 0.30
AKT1 P31749 2/20 0.30

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
SCHEMBL4746257 1.00 TNF (0.34) TNFIKBKETBK1CYP11B1CYP11B2
SCHEMBL4745894 0.92 TOP2A (0.33) CYP11B1CYP11B2TOP2AFEN1
SCHEMBL13320398 0.89 TNF (0.39) TNFIKBKETBK1CYP11B1CYP11B2
SCHEMBL13320391 0.89 TNF (0.39) TNFIKBKETBK1CYP11B1CYP11B2
SCHEMBL4746263 0.86 CYP17A1 (0.31) CYP17A1CYP1A2
SCHEMBL4746261 0.86 CYP17A1 (0.31) CYP17A1CYP1A2
SCHEMBL13854887 0.83 TNF (0.47) TNFIKBKETBK1CYP11B1CYP11B2
SCHEMBL13854888 0.83 TNF (0.47) TNFIKBKETBK1CYP11B1CYP11B2
SCHEMBL4746256 0.80 PTPRC (0.38) TOP2ACYP1A2
SCHEMBL4746255 0.80 PTPRC (0.38) TOP2ACYP1A2

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
US-8173275-B2 Azaindenochrysene derivative and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2012-05-08 US disclosed
US-8173275-B2 Azaindenochrysene derivative and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2012-05-08 US disclosed
US-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-05-13 US disclosed
US-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-05-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE NR2E3, OR51E2, AZI2 TNF 1055/4885IKBKE 2657/4885TBK1 1310/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.