SCHEMBL1102818

SCHEMBL1102818

c1ccc(-n2c(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccncc45)cc3)nc3ccccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
HSP90AA1 P07900 1/20 0.44
KMT2A Q03164 1/20 0.44
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
ALDH1A1 P00352 2/20 0.42
MDM2 Q00987 1/20 0.42
RECQL P46063 1/20 0.41
GRIA1 P42261 1/20 0.41
CACNG8 Q8WXS5 1/20 0.41
CACNG2 Q9Y698 1/20 0.41
TNF P01375 1/20 0.40
AOC3 Q16853 4/20 0.39
KCNH2 Q12809 1/20 0.39
HTT P42858 2/20 0.38
MAPK1 P28482 1/20 0.38
RPS6KA5 O75582 1/20 0.38
GFER P55789 1/20 0.38
NPSR1 Q6W5P4 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 0.91 ESR1 (0.51) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL10028918 0.91 ESR1 (0.51) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL1102644 0.90 ESR1 (0.53) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL12886878 0.90 MAPT (0.39) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL12887250 0.90 MAPT (0.39) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL2604829 0.88 ESR1 (0.56) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL14000030 0.87 ESR1 (0.55) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL15696436 0.87 ESR1 (0.51) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL1102663 0.86 MAPT (0.45) MAPTMEN1HSP90AA1KMT2AESR1
SCHEMBL12571639 0.86 ESR1 (0.46) 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.