SCHEMBL13487514

SCHEMBL13487514

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccncn4)c4ccc(-c5ccccc5)cc34)ccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.35
PIK3CA P42336 1/20 0.34
SCN9A Q15858 1/20 0.34
IMPDH2 P12268 1/20 0.32
MAPK13 O15264 1/20 0.31
RAF1 P04049 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
MKNK1 Q9BUB5 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
BRAF P15056 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
SCHEMBL13487736 0.95 PDK2 (0.36) PDK2SCN9A
SCHEMBL13487902 0.95 PDK2 (0.38) PDK2PIK3CASCN9AIMPDH2MAPK13
SCHEMBL13488128 0.91 PDK2 (0.38) PDK2SCN9A
SCHEMBL13487666 0.91 MAPK9 (0.36) PDK2SCN9AMAPK9
SCHEMBL13487605 0.90 CCNT1 (0.33) SCN9AMAPK11MAPK14
SCHEMBL13487447 0.89 PDK2 (0.33) PDK2
SCHEMBL13487517 0.88 PDK2 (0.32) PDK2PIK3CA
SCHEMBL13487507 0.88 PDK2 (0.39) PDK2PIK3CA
SCHEMBL13487515 0.88 PDK2 (0.41) PDK2PIK3CAIMPDH2MAPK14MKNK1
SCHEMBL13487112 0.87 SCN9A (0.36) PDK2PIK3CASCN9AIMPDH2MAPK13

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 1456/4885PIK3CA 3662/4885SCN9A 3329/4885

“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.