SCHEMBL13487111

SCHEMBL13487111

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4ncncn4)c4ccc(-c5ccccc5)cc34)cccc21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.31
PDK2 Q15119 2/20 0.31
PIK3CA P42336 1/20 0.31
MAP4K4 O95819 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
SCHEMBL13487359 0.92 PDK2 (0.31) PDK2
SCHEMBL13487109 0.91 PIK3CA (0.32) PDK2PIK3CA
SCHEMBL13487282 0.90 KDM4E (0.34) CYP17A1
SCHEMBL13487178 0.89 MCL1 (0.32)
SCHEMBL13487517 0.88 PDK2 (0.32) PDK2PIK3CAMAP4K4
SCHEMBL13487112 0.87 SCN9A (0.36) CYP17A1PDK2PIK3CA
SCHEMBL13487900 0.87 PDK2 (0.36) PDK2PIK3CAMAP4K4
SCHEMBL13487050 0.86 PDK2 (0.31) PDK2
SCHEMBL13487137 0.86 L3MBTL1 (0.32) PDK2
SCHEMBL13487114 0.85 PDK2 (0.39) CYP17A1PDK2

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-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

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 CYP17A1 911/4885PDK2 1456/4885PIK3CA 3662/4885

“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.