SCHEMBL4745828

SCHEMBL4745828

CC(C)(C)c1ccc2c(c1)c(-c1cc(-c3ccccc3)cc(-c3ccccc3)c1)cc1c3cccc4c3c(cc21)-c1ncccc1-4

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.36
KIF11 P52732 4/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
TRPV1 Q8NER1 5/20 0.32
ABCG2 Q9UNQ0 1/20 0.30
TOP2A P11388 1/20 0.30
CCR9 P51686 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
SCHEMBL4745800 0.95 ALDH1A1 (0.36) KDRKIF11ALDH1A1KDM4EKMT2A
SCHEMBL4745799 0.88 TOP2A (0.36) ALDH1A1KMT2ATOP2A
SCHEMBL4746335 0.82 ALDH1A1 (0.39) ALDH1A1KMT2ATOP2A
SCHEMBL4745821 0.81 PTGS1 (0.40) ALDH1A1KMT2ATOP2A
SCHEMBL4745857 0.81 KDR (0.38) KDRKIF11ALDH1A1KDM4EKMT2A
SCHEMBL4746298 0.81 PTPRC (0.38) ALDH1A1KMT2ATOP2A
SCHEMBL4746306 0.79 PTGS1 (0.35) ALDH1A1KMT2ATOP2A
SCHEMBL4746300 0.79 PTPRC (0.38) ALDH1A1KMT2ATOP2A
SCHEMBL4746287 0.77 PTPRC (0.39) ALDH1A1KMT2ATOP2A
SCHEMBL4746454 0.76 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2AMAPTTOP2A

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 KDR 944/4885KIF11 3163/4885ALDH1A1 179/4885

“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.