SCHEMBL13487590

SCHEMBL13487590

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc(F)cc4)c4ccc(-c5cccc6ccccc56)cc34)ccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.33
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
MAPK13 O15264 1/20 0.33
GCGR P47871 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
PGR P06401 2/20 0.33
ACHE P22303 1/20 0.33
ENPP1 P22413 2/20 0.32
CYP1A2 P05177 3/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHRNA1 P02708 1/20 0.32

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
SCHEMBL13487969 0.93 PDK2 (0.38) PDK2MCL1ACMSDMAPK13GCGR
SCHEMBL13487652 0.89 PDK2 (0.36) PDK2PGRACHECYP1A2KDM4E
SCHEMBL13487167 0.89 MCL1 (0.33) PDK2MCL1ACMSDMAPK13GCGR
SCHEMBL13487615 0.88 EPHX2 (0.36) PDK2MCL1ACMSDENPP1
SCHEMBL13487599 0.88 MAPK11 (0.38) PDK2MCL1ACMSDMAPK13GCGR
SCHEMBL13487740 0.87 PDK2 (0.43) PDK2PGRACHE
SCHEMBL13487505 0.87 PDK2 (0.40) PDK2PGRACHECYP1A2KDM4E
SCHEMBL13487625 0.87 CYP1A2 (0.38) PDK2PGRACHEENPP1CYP1A2
SCHEMBL13487640 0.86 MCL1 (0.34) MCL1ACMSDENPP1CYP1A2KDM4E
SCHEMBL13487610 0.86 MCL1 (0.37) PDK2MCL1ACMSDPGRCYP1A2

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 1456/4885MCL1 2343/4885ACMSD 191/4885

“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.