SCHEMBL1102663

SCHEMBL1102663

c1ccc(-n2c(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccncc45)cc3)nc3ccccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
HSP90AA1 P07900 1/20 0.45
KMT2A Q03164 1/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPK10 P53779 4/20 0.43
MDM2 Q00987 1/20 0.43
GRIA1 P42261 1/20 0.41
CACNG8 Q8WXS5 1/20 0.41
CACNG2 Q9Y698 1/20 0.41
AOC3 Q16853 3/20 0.41
KCNH2 Q12809 1/20 0.40
PTGER4 P35408 1/20 0.39
GRM1 Q13255 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RPS6KA5 O75582 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL1102650 0.92 ESR1 (0.51) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL12886822 0.91 MAPT (0.40) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL1102644 0.91 ESR1 (0.53) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL134057 0.91 ESR1 (0.52) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL13098744 0.91 ESR1 (0.52) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL29444817 0.91 ESR1 (0.52) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL12887159 0.91 MAPT (0.39) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL25668057 0.90 MEN1 (0.52) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL24811898 0.90 ESR1 (0.51) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL24810896 0.89 MDM2 (0.52) MAPTMEN1HSP90AA1KMT2AESR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
EP-2147962-A1 Azaanthracene-derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-27 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 MAPT 3162/4885MEN1 4462/4885HSP90AA1 4884/4885

“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.