SCHEMBL22595449

SCHEMBL22595449

c1ccc(-c2nc(-c3ccc(-c4cccc5ccccc45)cc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccccc4)cc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.45
▸ ATM Q13315 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ TNF P01375 1/20 0.38

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
SCHEMBL22595868 0.95 KDM4E (0.41) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL24152098 0.94 KDM4E (0.41) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL19276001 0.94 KDM4E (0.47) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL17943379 0.93 KDM4E (0.40) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL14749024 0.93 KDM4E (0.41) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL14749052 0.93 KDM4E (0.41) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL17943382 0.92 KDM4E (0.46) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL23232866 0.92 KDM4E (0.53) KDM4EATML3MBTL1MAPTCA12
SCHEMBL17736930 0.92 KDM4E (0.37) KDM4EATML3MBTL1MAPTALDH1A1
SCHEMBL14749070 0.92 KDM4E (0.39) KDM4EATML3MBTL1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200343450-A1 ORGANIC LIGHT-EMITTING DIODE LG CHEM, LTD. (KR) 2020-10-29 — — 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 (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-20200343450-A1 ORGANIC LIGHT-EMITTING DIODE NR2E3, LAS1L, CRY1 KDM4E 2212/4885ATM 2748/4885L3MBTL1 351/4885

“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.

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