SCHEMBL13488166

SCHEMBL13488166

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5cc(-c6ccccn6)cc(-c6ccccn6)c5)c5ccccc5c(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c4c3)cc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.44
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
BRD4 O60885 2/20 0.33
NPY5R Q15761 1/20 0.32
PRMT5 O14744 2/20 0.32
WDR77 Q9BQA1 1/20 0.32
HTR2C P28335 1/20 0.32
DHODH Q02127 1/20 0.32
ERN1 O75460 1/20 0.31
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
BTK Q06187 1/20 0.31

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
SCHEMBL13487774 0.97 PDK2 (0.42) PDK2KDM4ENPC1BRD4NPY5R
SCHEMBL13487929 0.97 PDK2 (0.42) PDK2KDM4ENPC1BRD4NPY5R
SCHEMBL13488125 0.94 PDK2 (0.44) PDK2KDM4ENPC1BRD4NPY5R
SCHEMBL13488086 0.94 PDK2 (0.40) PDK2KDM4ENPC1NPY5RHTR2C
SCHEMBL13487394 0.92 PDK2 (0.41) PDK2KDM4ENPC1BRD4HTR2C
SCHEMBL13487846 0.92 PDK2 (0.42) PDK2KDM4ENPC1NPY5RBTK
SCHEMBL13488007 0.92 PDK2 (0.40) PDK2KDM4ENPC1BRD4NPY5R
SCHEMBL13487549 0.91 PDK2 (0.39) PDK2KDM4ENPC1NPY5RPRMT5
SCHEMBL13487759 0.91 PDK2 (0.42) PDK2KDM4ENPC1BRD4NPY5R
SCHEMBL13487898 0.91 PDK2 (0.42) PDK2KDM4EBRD4HTR2CDHODH

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 1456/4885KDM4E 3671/4885NPC1 1139/4885

“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.