SCHEMBL13487353

SCHEMBL13487353

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccccn5)c5ccccc5c(-c5cccc6c5-c5ccccc5C6(C)C)c4c3)cc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.41
HTR2C P28335 1/20 0.34
BRD4 O60885 2/20 0.32
DHODH Q02127 1/20 0.32
KDM4E B2RXH2 2/20 0.30
NPC1 O15118 2/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL13487394 0.94 PDK2 (0.41) PDK2HTR2CBRD4DHODHKDM4E
SCHEMBL13487102 0.93 PDK2 (0.36) PDK2HTR2CBRD4DHODHKDM4E
SCHEMBL13487355 0.91 PDK2 (0.34) PDK2HTR2C
SCHEMBL13488125 0.91 PDK2 (0.44) PDK2HTR2CBRD4DHODHKDM4E
SCHEMBL13487273 0.90 KDM4E (0.38) PDK2HTR2CDHODHKDM4ENPC1
SCHEMBL13487356 0.89 ALOX5AP (0.35) PDK2
SCHEMBL13487170 0.89 HTR2C (0.42) PDK2HTR2CDHODHKDM4ENPC1
SCHEMBL13487360 0.88 PDK2 (0.35) PDK2
SCHEMBL13487759 0.87 PDK2 (0.42) PDK2HTR2CBRD4DHODHKDM4E
SCHEMBL13487898 0.87 PDK2 (0.42) PDK2HTR2CBRD4DHODHKDM4E

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 1456/4885HTR2C 4442/4885BRD4 2568/4885

“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.