SCHEMBL13021799

SCHEMBL13021799

c1cc(-c2cccc(-c3ccc4c5ccncc5c5ccccc5c4c3)c2)cc(-c2ccc3c4ccccc4c4ccccc4c3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
HTT P42858 2/20 0.43
TNF P01375 1/20 0.43
POLB P06746 1/20 0.43
RAD52 P43351 1/20 0.43
CYP11B1 P15538 2/20 0.42
CSNK2A2 P19784 2/20 0.41
CSNK2B P67870 2/20 0.41
PARP1 P09874 3/20 0.41
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B2 P19099 1/20 0.41
MAPK10 P53779 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.40
MKNK1 Q9BUB5 2/20 0.39
ACHE P22303 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
IKBKB O14920 1/20 0.39
AURKA O14965 1/20 0.39

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
SCHEMBL13021798 1.00 KDM4E (0.43) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021784 1.00 KDM4E (0.43) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021781 1.00 KDM4E (0.43) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021754 0.96 MAPK10 (0.45) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021744 0.96 MAPK10 (0.45) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021752 0.96 MAPK10 (0.45) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021741 0.96 MAPK10 (0.45) KDM4EHTTTNFPOLBRAD52
SCHEMBL18252357 0.91 TNF (0.44) KDM4EHTTTNFPOLBRAD52
SCHEMBL18252361 0.91 TNF (0.44) KDM4EHTTTNFPOLBRAD52
SCHEMBL13021735 0.87 GPR3 (0.39) KDM4EHTTTNFPOLBRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2520571-B1 2-azatriphenylene materials for organic light emitting diodes UNIVERSAL DISPLAY CORP (US) 2016-08-17 EP disclosed
US-9005771-B2 2-azatriphenylene materials for organic light emitting diodes UNIVERSAL DISPLAY CORPORATION (US) 2015-04-14 US disclosed
US-9005771-B2 2-azatriphenylene materials for organic light emitting diodes UNIVERSAL DISPLAY CORPORATION (US) 2015-04-14 US disclosed
EP-2429997-B1 2-AZATRIPHENYLENE MATERIALS FOR ORGANIC LIGHT EMITTING DIODES UNIVERSAL DISPLAY CORP (US) 2014-01-15 EP disclosed
US-20100289406-A1 2-AZATRIPHENYLENE MATERIALS FOR ORGANIC LIGHT EMITTING DIODES UNIVERSAL DISPLAY CORPORATION (US) 2010-11-18 US disclosed
US-20100289406-A1 2-AZATRIPHENYLENE MATERIALS FOR ORGANIC LIGHT EMITTING DIODES UNIVERSAL DISPLAY CORPORATION (US) 2010-11-18 US disclosed
WO-2010132524-A1 2-AZATRIPHENYLENE MATERIALS FOR ORGANIC LIGHT EMITTING DIODES UNIVERSAL DISPLAY CORPORATION (US) 2010-11-18 WO 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-20100289406-A1 2-AZATRIPHENYLENE MATERIALS FOR ORGANIC LIGHT EMITTING DIODES DDT, NR2E3, ALKBH2 KDM4E 113/4885HTT 236/4885TNF 3793/4885

“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.