SCHEMBL4745875

SCHEMBL4745875

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7cc8c9cccc%10c9c(cc8c8ccccc78)-c7ncccc7-%10)ccc5-6)ccc3-4)cc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.34
FEN1 P39748 1/20 0.32
TGFBR1 P36897 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 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
SCHEMBL4745879 1.00 PDK2 (0.34) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL4745820 0.99 PDK2 (0.34) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL4746429 0.98 TGFBR1 (0.33) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL4746419 0.97 TGFBR1 (0.34) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL4745865 0.94 FEN1 (0.36) PDK2FEN1TGFBR1
SCHEMBL4746145 0.93 PDK2 (0.36) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL4746105 0.89 PDK2 (0.34) PDK2TGFBR1CYP1A2CYP2C19KMT2A
SCHEMBL13320380 0.88 PDK2 (0.37) PDK2FEN1TGFBR1CYP1A2CYP2C19
SCHEMBL13320367 0.83 ALDH1A1 (0.35) PDK2TGFBR1CYP1A2CYP2C19KMT2A
SCHEMBL4745858 0.83 FEN1 (0.33) PDK2FEN1

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 4048/4885FEN1 1309/4885TGFBR1 1895/4885

“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.