SCHEMBL21163385

SCHEMBL21163385

N#Cn1c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)c4cc(-n6c7ccccc7c7ccccc76)ccc4n5C#N)n3)cc2c2cc(-n3c4ccccc4c4ccccc43)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.37
KDM4E B2RXH2 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RAC2 P15153 1/20 0.37
RAC3 P60763 1/20 0.37
CDC42 P60953 1/20 0.37
RAC1 P63000 1/20 0.37
PTGER4 P35408 2/20 0.34
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 4/20 0.34
CYP1A2 P05177 4/20 0.34
CYP3A4 P08684 3/20 0.34
CYP2C19 P33261 2/20 0.34
CLK4 Q9HAZ1 2/20 0.34
CYP2D6 P10635 2/20 0.34
TSHR P16473 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NPY5R Q15761 2/20 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
SCHEMBL21163201 0.96 KDM4E (0.37) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL30118224 0.91 MEN1 (0.39) ATMKDM4EL3MBTL1PTGER4MEN1
SCHEMBL30118237 0.87 L3MBTL1 (0.51) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL15248715 0.87 L3MBTL1 (0.51) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL15248677 0.87 L3MBTL1 (0.51) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL24677071 0.87 L3MBTL1 (0.51) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL12093303 0.87 L3MBTL1 (0.51) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL30118254 0.87 NPY5R (0.37) KDM4EPTGER4MEN1KMT2AALDH1A1
SCHEMBL22672166 0.86 L3MBTL1 (0.50) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL21965167 0.86 ATM (0.42) ATMKDM4EL3MBTL1RAC2RAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11575088-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2023-02-07 US disclosed
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2019-06-27 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-11575088-B2 Composition of matter for use in organic light-emitting diodes CRY2, CYBA, ALDH1A2 ATM 2253/4885KDM4E 4556/4885L3MBTL1 1186/4885
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, CYBA, ALDH1A2 ATM 2253/4885KDM4E 4556/4885L3MBTL1 1186/4885

“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.