SCHEMBL13487512

SCHEMBL13487512

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4cccnc4)c4ccc(-c5ccccc5)cc34)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.42
TDP2 O95551 2/20 0.38
CYP11B1 P15538 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
LMNA P02545 1/20 0.36
RAF1 P04049 1/20 0.36
MAPK1 P28482 1/20 0.36
HIF1A Q16665 1/20 0.36
CHEK1 O14757 2/20 0.35
CYP19A1 P11511 2/20 0.35
CYP17A1 P05093 1/20 0.35
CYP11B2 P19099 1/20 0.35
KDR P35968 2/20 0.35
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
JAK2 O60674 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35

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
SCHEMBL13487757 0.94 PDK2 (0.46) PDK2TDP2CYP11B1CYP1A2CYP3A4
SCHEMBL13487899 0.93 PDK2 (0.47) PDK2TDP2CYP11B1CYP1A2CYP3A4
SCHEMBL13487655 0.91 CYP11B2 (0.49) PDK2CYP11B1CYP1A2CYP3A4CYP19A1
SCHEMBL13488129 0.91 PDK2 (0.49) PDK2TDP2CYP11B1CYP1A2CYP3A4
SCHEMBL13487444 0.90 MAP2K4 (0.40) PDK2CYP11B1CYP1A2CYP3A4MAPK1
SCHEMBL15977617 0.90 PDK2 (0.51) PDK2TDP2CYP11B1CYP1A2CYP3A4
SCHEMBL13487518 0.90 ATM (0.36) PDK2CYP1A2CYP3A4LMNARAF1
SCHEMBL13487603 0.89 KDM4E (0.41) PDK2CYP11B1CYP1A2CYP3A4CYP19A1
SCHEMBL13487515 0.88 PDK2 (0.41) PDK2CHEK1KDRMAP4K4PRKACA
SCHEMBL13487106 0.88 PDK2 (0.43) PDK2TDP2CYP11B1CYP1A2CYP3A4

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 PDK2 1456/4885TDP2 2332/4885CYP11B1 492/4885

“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.