SCHEMBL1103025

SCHEMBL1103025

c1ccc(N2c3ccccc3N(c3c4ccccc4c(N4c5ccccc5N(c5ccccc5)c5ccccc54)c4ncccc34)c3ccccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.37
MAPT P10636 3/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
KAT2B Q92831 1/20 0.36
LDHA P00338 1/20 0.36
CYP2C19 P33261 3/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
HSP90AA1 P07900 4/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 2/20 0.35
PAX8 Q06710 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL1102903 0.81 KDM4E (0.43) KDM4EMAPTADRA2AADRA2BADRA2C
SCHEMBL1102977 0.81 HTT (0.38) KDM4EMAPTADRA2AADRA2BADRA2C
SCHEMBL1102797 0.81 HTT (0.38) KDM4EMAPTCYP2C19HTTALDH1A1
SCHEMBL1102902 0.80 L3MBTL1 (0.36) KDM4EMAPTCYP2C19HTTALDH1A1
SCHEMBL1102901 0.79 HTT (0.38) KDM4EMAPTCYP2C19HTTALDH1A1
SCHEMBL1102983 0.79 KMT2A (0.40) CYP2C19HTTTSHRHSP90AA1L3MBTL1
SCHEMBL1102807 0.77 HSP90AA1 (0.36) KDM4EMAPTCYP2C19HTTHSP90AA1
SCHEMBL1102517 0.75 ADRA2A (0.38) KDM4EMAPTADRA2AADRA2BADRA2C
SCHEMBL1103018 0.75 KDM4E (0.34) KDM4EMAPTCYP2C19HTTALDH1A1
SCHEMBL20837196 0.73 ADRA2A (0.39) KDM4EMAPTADRA2AADRA2BADRA2C

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 KDM4E 3367/4885MAPT 3162/4885ADRA2A 2843/4885

“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.