SCHEMBL20409592

SCHEMBL20409592

CC1(C)COC(c2ccc(-c3ccc4c5ccc(-c6ccc(C7=NC(C)(C)CO7)cc6)cc5c5ccccc5c4c3)cc2)=N1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
MAPT P10636 1/20 0.45
HRH3 Q9Y5N1 4/20 0.44
CYP2D6 P10635 1/20 0.44
IL2 P60568 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ATM Q13315 1/20 0.37
S1PR3 Q99500 1/20 0.36
ROCK1 Q13464 1/20 0.34

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 0.91 KDM4E (0.49) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20396129 0.91 KDM4E (0.49) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20396075 0.88 KDM4E (0.42) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20410315 0.88 HRH3 (0.43) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20410295 0.86 KDM4E (0.44) KDM4ELMNAHTTMAPTHRH3
SCHEMBL10837608 0.84 KDM4E (0.56) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20410312 0.84 KDM4E (0.48) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20409698 0.83 KDM4E (0.42) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20410729 0.83 KDM4E (0.53) KDM4ELMNAHTTMAPTHRH3
SCHEMBL20410580 0.83 KDM4E (0.51) KDM4ELMNAHTTMAPTHRH3

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
US-11877506-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2024-01-16 US disclosed
US-11877506-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2024-01-16 US disclosed
US-20230276708-A1 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-08-31 US disclosed
US-20230276708-A1 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-08-31 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-11877506-B2 Polycyclic aromatic compound F11, C1R, RNF31 KDM4E 4253/4885LMNA 692/4885HTT 2448/4885
US-20230276708-A1 Polycyclic aromatic compound ACVR1B, XDH, AHR KDM4E 583/4885LMNA 1220/4885HTT 3714/4885
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 776/4885LMNA 1407/4885HTT 1606/4885
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 776/4885LMNA 1407/4885HTT 1606/4885

“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.