SCHEMBL22258138

SCHEMBL22258138

c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5cccc6oc7cc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)ccc7c56)cc43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HDAC4 P56524 1/20 0.32
BACE1 P56817 1/20 0.32
PTGER4 P35408 1/20 0.31
HCRTR1 O43613 1/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTPN1 P18031 1/20 0.31

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
SCHEMBL23557959 0.97 PTGER4 (0.35) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL22257643 0.97 KDM4E (0.39) KDM4EATML3MBTL1BACE1HCRTR1
SCHEMBL23557930 0.97 L3MBTL1 (0.36) KDM4EATML3MBTL1HDAC4BACE1
SCHEMBL21192114 0.96 KDM4E (0.37) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL23557914 0.96 L3MBTL1 (0.37) KDM4EATML3MBTL1HDAC4BACE1
SCHEMBL23557877 0.95 KDM4E (0.35) KDM4EATML3MBTL1HDAC4BACE1
SCHEMBL21192248 0.95 KDM4E (0.38) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL23557929 0.95 KDM4E (0.35) KDM4EATML3MBTL1HDAC4BACE1
SCHEMBL23557985 0.95 KDM4E (0.35) KDM4EATML3MBTL1HDAC4BACE1
SCHEMBL22257965 0.95 KDM4E (0.35) KDM4EATML3MBTL1HDAC4BACE1

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-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20200231578-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-07-23 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-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES SLCO2B1, SLCO2A1, SLCO1B3 KDM4E 3745/4885ATM 4632/4885L3MBTL1 3258/4885
US-20200231578-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES SLCO2B1, SLCO2A1, SLCO1B3 KDM4E 3745/4885ATM 4632/4885L3MBTL1 3258/4885

“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.