SCHEMBL13426348

SCHEMBL13426348

CN1c2ccccc2CCc2ccc(-c3c4ccc(N5CCCCC5)cc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc(N5CCCCC5)cc34)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.37
ALK Q9UM73 2/20 0.33
AVPR2 P30518 3/20 0.33
PTGS2 P35354 1/20 0.32
ALDH1A1 P00352 5/20 0.32
MAPT P10636 4/20 0.32
MAPK1 P28482 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 2/20 0.32
ALOX15 P16050 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
LMNA P02545 1/20 0.32
S100B P04271 1/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
POLB P06746 1/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 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
SCHEMBL13426336 0.94 PDK2 (0.37) PDK2ALKPTGS2ALDH1A1MAPT
SCHEMBL13425861 0.89 AVPR2 (0.39) AVPR2PTGS2ALDH1A1MAPTMAPK1
SCHEMBL13426390 0.89 PDK2 (0.37) PDK2ALKAVPR2KIF11
SCHEMBL13426379 0.88 PDK2 (0.36) PDK2ALKPTGS2ALDH1A1MAPT
SCHEMBL13488190 0.87 CHEK1 (0.32) PDK2DRD2HTR6
SCHEMBL13425667 0.87 PDK2 (0.46) PDK2ALKALDH1A1MAPTMAPK1
SCHEMBL13425988 0.86 KIF11 (0.38) AVPR2ALDH1A1MAPTMAPK1HTT
SCHEMBL13425757 0.85 PDK2 (0.44) PDK2ALKALDH1A1MAPTMAPK1
SCHEMBL13487864 0.85 PDK2 (0.32) PDK2MAPTHTTKMT2ALMNA
SCHEMBL13487946 0.85 HSD17B3 (0.36) PDK2KMT2A

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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
EP-2141214-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-06 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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same RPL36, RPL39, RPL36A PDK2 3608/4885ALK 1441/4885AVPR2 2997/4885

“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.