SCHEMBL4746450

SCHEMBL4746450

CC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc6c7ccc(-c8ccccc8)c8c7c(cc6c6ccc(-c7ccccc7)cc56)-c5ncccc5-8)ccc3-4)ccc2-c2ccc(-c3cc4c5ccc(-c6ccccc6)c6c5c(cc4c4ccc(-c5ccccc5)cc34)-c3ncccc3-6)cc21

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.34
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
PDK2 Q15119 1/20 0.31
PIK3CA P42336 1/20 0.31

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
SCHEMBL4746470 1.00 FEN1 (0.34) FEN1PTGS1PTGS2PDK2PIK3CA
SCHEMBL4745842 1.00 FEN1 (0.34) FEN1PTGS1PTGS2PDK2PIK3CA
SCHEMBL4745899 0.98 FEN1 (0.33) FEN1PTGS1PTGS2PDK2
SCHEMBL4745858 0.98 FEN1 (0.33) FEN1PTGS1PTGS2PDK2
SCHEMBL4746334 0.89 PIK3CA (0.36) FEN1PTGS1PTGS2PIK3CA
SCHEMBL4746316 0.89 PIK3CA (0.36) FEN1PTGS1PTGS2PIK3CA
SCHEMBL4746325 0.88 FEN1 (0.35) FEN1PTGS1PTGS2PIK3CA
SCHEMBL4746330 0.88 FEN1 (0.35) FEN1PTGS1PTGS2PIK3CA
SCHEMBL4746391 0.86 FEN1 (0.34) FEN1PTGS1PTGS2PIK3CA
SCHEMBL4746385 0.85 FEN1 (0.34) FEN1PTGS1PTGS2PIK3CA

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-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

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 FEN1 1309/4885PTGS1 2683/4885PTGS2 1847/4885

“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.