SCHEMBL20396129

SCHEMBL20396129

CC1(C)COC(c2cccc(-c3ccc4c5ccc(-c6cccc(C7=NC(C)(C)CO7)c6)cc5c5ccccc5c4c3)c2)=N1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
HRH3 Q9Y5N1 4/20 0.47
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
ROCK1 Q13464 1/20 0.41
IL2 P60568 1/20 0.41
CYP2D6 P10635 1/20 0.40
S1PR3 Q99500 1/20 0.37
ALDH1A1 P00352 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL29511673 1.00 KDM4E (0.49) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20409592 0.91 KDM4E (0.47) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20409902 0.88 KDM4E (0.43) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20410315 0.88 HRH3 (0.43) KDM4EHRH3LMNAHTTMAPT
SCHEMBL29689817 0.87 KDM4E (0.53) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20396188 0.87 KDM4E (0.53) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20410843 0.86 KDM4E (0.59) KDM4EHRH3LMNAHTTMAPT
SCHEMBL471881 0.86 KDM4E (0.62) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20409942 0.85 KDM4E (0.51) KDM4EHRH3LMNAHTTMAPT
SCHEMBL20410829 0.85 KDM4E (0.51) KDM4EHRH3LMNAHTTMAPT

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-11342511-B2 Azoline ring-containing compound, electron transport/injection layer material containing the same, and organic electroluminescent element using the same SK MATERIALS JNC CO., LTD. (KR) 2022-05-24 US disclosed
US-11342511-B2 Azoline ring-containing compound, electron transport/injection layer material containing the same, and organic electroluminescent element using the same SK MATERIALS JNC CO., LTD. (KR) 2022-05-24 US disclosed
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME JNC CORPORATION (JP) 2018-07-26 US disclosed
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME JNC CORPORATION (JP) 2018-07-26 US disclosed
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME JNC CORPORATION (JP) 2018-07-26 US 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 (2 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-11342511-B2 Azoline ring-containing compound, electron transport/injection layer material containing the same, and organic electroluminescent element using the same SLC7A5, EML4, ARNT KDM4E 776/4885HRH3 1096/4885LMNA 1407/4885
US-20180212156-A1 AZOLINE RING-CONTAINING COMPOUND, ELECTRON TRANSPORT/INJECTION LAYER MATERIAL CONTAINING THE SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME SLC7A5, EML4, ARNT KDM4E 776/4885HRH3 1096/4885LMNA 1407/4885

“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.