SCHEMBL13488128

SCHEMBL13488128

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccncn5)c5ccccc5c(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c4c3)cc21

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.38
SCN9A Q15858 1/20 0.32
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
CYP2D6 P10635 1/20 0.30
EDNRA P25101 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
SCHEMBL13487902 0.97 PDK2 (0.38) PDK2SCN9A
SCHEMBL13487736 0.97 PDK2 (0.36) PDK2SCN9A
SCHEMBL13488056 0.94 MAPK9 (0.37) PDK2SCN9ACYP2D6
SCHEMBL13487974 0.92 SCN9A (0.34) PDK2SCN9A
SCHEMBL13487860 0.92 PDK2 (0.34) PDK2EDNRA
SCHEMBL13487360 0.91 PDK2 (0.35) PDK2SCN9A
SCHEMBL13487514 0.91 PDK2 (0.35) PDK2SCN9A
SCHEMBL13487666 0.88 MAPK9 (0.36) PDK2SCN9ACYP2D6
SCHEMBL15977559 0.88 PDK2 (0.49) PDK2
SCHEMBL13488126 0.88 PDK2 (0.46) PDK2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
EP-2108689-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-10-14 EP 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 PDK2 1456/4885SCN9A 3329/4885ALOX5AP 230/4885

“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.