SCHEMBL4746094

SCHEMBL4746094

CC1(C)c2ccccc2-c2nccc(-c3cc4c5cccc6c5c(cc4c4ccccc34)-c3ncccc3-6)c21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
TOP2A P11388 1/20 0.32
CTSL P07711 1/20 0.30
PTPRC P08575 1/20 0.30
CTSS P25774 1/20 0.30
PTPN13 Q12923 1/20 0.30
NR3C1 P04150 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 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
SCHEMBL13320376 0.92 ALDH1A1 (0.38) PDK2CYP1A2CYP2C19KMT2ANR3C1
SCHEMBL4746267 0.82 ALDH1A1 (0.42) CYP1A2KMT2ATOP2ACTSLPTPRC
SCHEMBL4746169 0.82 PDK2 (0.33) PDK2
SCHEMBL4746189 0.81 PDK2 (0.33) PDK2CYP1A2CYP2C19KMT2ATOP2A
SCHEMBL4746392 0.81 ALDH1A1 (0.41) CYP1A2KMT2ATOP2ACTSLPTPRC
SCHEMBL4745820 0.81 PDK2 (0.34) PDK2CYP1A2CYP2C19KMT2A
SCHEMBL4746145 0.80 PDK2 (0.36) PDK2CYP1A2CYP2C19KMT2A
SCHEMBL4745875 0.80 PDK2 (0.34) PDK2CYP1A2CYP2C19KMT2A
SCHEMBL4745879 0.80 PDK2 (0.34) PDK2CYP1A2CYP2C19KMT2A
SCHEMBL4746105 0.80 PDK2 (0.34) PDK2CYP1A2CYP2C19KMT2A

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 PDK2 4048/4885CYP1A2 56/4885CYP2C19 99/4885

“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.