SCHEMBL4745800

SCHEMBL4745800

CC(C)(C)c1ccc2c(c1)c(-c1ccc(-c3ccccc3)cc1)cc1c3cccc4c3c(cc21)-c1ncccc1-4

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
KDR P35968 1/20 0.36
TRPV1 Q8NER1 9/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
KIF11 P52732 2/20 0.34
MAPT P10636 1/20 0.34
TOP1 P11387 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32

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
SCHEMBL4745828 0.95 KDR (0.36) ALDH1A1KDM4EKMT2AKDRTRPV1
SCHEMBL4745821 0.87 PTGS1 (0.40) ALDH1A1KMT2APTGS1PTGS2TOP1
SCHEMBL4746300 0.85 PTPRC (0.38) ALDH1A1KMT2APTGS1PTGS2
SCHEMBL4746287 0.83 PTPRC (0.39) ALDH1A1KMT2APTGS1PTGS2
SCHEMBL4746306 0.82 PTGS1 (0.35) ALDH1A1KMT2APTGS1PTGS2
SCHEMBL4745857 0.82 KDR (0.38) ALDH1A1KDM4EKMT2AKDRTRPV1
SCHEMBL4745799 0.81 TOP2A (0.36) ALDH1A1KMT2APTGS1PTGS2
SCHEMBL4746298 0.80 PTPRC (0.38) ALDH1A1KMT2APTGS1PTGS2
SCHEMBL4745817 0.79 TOP2A (0.36) ALDH1A1KMT2AKDRPTGS1PTGS2
SCHEMBL4746335 0.78 ALDH1A1 (0.39) ALDH1A1KMT2A

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 ALDH1A1 179/4885KDM4E 219/4885KMT2A 781/4885

“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.