SCHEMBL13487669

SCHEMBL13487669

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4cc(-c5ccccc5)c5ccccc5n4)c4ccc(-c5ccc6ccccc6c5)cc34)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 7/20 0.41
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 4/20 0.33
MAPT P10636 3/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
NFKB1 P19838 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
SCHEMBL13488060 0.95 ACACA (0.42) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487520 0.94 ACACA (0.42) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487810 0.93 ACACA (0.41) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487621 0.90 ACACA (0.39) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487661 0.90 NPC1 (0.36) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13488134 0.90 ACACA (0.43) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487670 0.89 ESR1 (0.39) ACACAESR1ESR2AURKAAURKB
SCHEMBL13487907 0.89 ACACA (0.43) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487715 0.88 CYP1A1 (0.38) ACACAKDM4EALDH1A1HPGDMAPT
SCHEMBL13487293 0.88 ACACA (0.41) ACACAKDM4EALDH1A1HPGDMAPT

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 ACACA 1675/4885KDM4E 3671/4885ALDH1A1 101/4885

“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.