Sugi Predict

Sugi Predict / Compounds / SCHEMBL20409671

SCHEMBL20409671

SCHEMBL20409671

CC1(C)COC(c2cccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)n2)=N1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.65
▸ DHFR P00374 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ ENPP3 O14638 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32
▸ CHRNA1 P02708 1/20 0.32
▸ CHRNG P07510 1/20 0.32

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
SCHEMBL20409963 0.91 KDM4E (0.79) KDM4EMAPTALDH1A1HTTATM
SCHEMBL757123 0.90 KDM4E (0.72) KDM4EDHFRNPC1MAPTSMN1; SMN2
SCHEMBL20409653 0.84 KDM4E (0.48) KDM4EDHFRNPC1MAPTSMN1; SMN2
SCHEMBL20409662 0.82 KDM4E (0.48) KDM4EDHFRNPC1MAPTSMN1; SMN2
SCHEMBL20409644 0.81 KDM4E (0.46) KDM4EDHFRNPC1MAPTSMN1; SMN2
SCHEMBL20409673 0.81 KDM4E (0.38) KDM4EDHFRNPC1MAPTSMN1; SMN2
SCHEMBL8855999 0.81 KDM4E (1.00) KDM4EMAPTALDH1A1HTTATM
SCHEMBL20409915 0.80 KDM4E (0.60) KDM4EMAPTALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7176715 0.78 KDM4E (0.93) KDM4EMAPTALDH1A1HTTATM
Hydrochloric Acid SCHEMBL7174211 0.78 KDM4E (0.93) KDM4EMAPTALDH1A1HTTATM

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 3 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-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 776/4885DHFR 3187/4885NPC1 999/4885
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 776/4885DHFR 3187/4885NPC1 999/4885

“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.