SCHEMBL13487116

SCHEMBL13487116

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4nc5ccccc5nc4-c4ccccc4)c4ccc(-c5ccccc5)cc34)cccc21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 6/20 0.36
LMNA P02545 6/20 0.36
ALDH1A1 P00352 5/20 0.36
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 6/20 0.36
NPSR1 Q6W5P4 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DHODH Q02127 2/20 0.34
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL13487373 0.95 TDP1 (0.36) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487292 0.94 KDM4E (0.36) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487182 0.93 TDP1 (0.36) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487118 0.92 KDM4E (0.38) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487072 0.90 ALDH1A1 (0.44) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487122 0.89 ESR1 (0.36) LMNAALDH1A1NPSR1DHODHSMN1; SMN2
SCHEMBL13487375 0.88 ALDH1A1 (0.36) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487908 0.87 TDP1 (0.38) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487522 0.87 TDP1 (0.38) TDP1KDM4ELMNAALDH1A1GAA
SCHEMBL13487295 0.86 KDM4E (0.35) TDP1KDM4ELMNAALDH1A1GAA

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 TDP1 1904/4885KDM4E 3671/4885LMNA 3760/4885

“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.