SCHEMBL23917305

SCHEMBL23917305

c1ccc(-n2c3ccccc3c3c4nc5ccccn5c4ccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.46
ATM Q13315 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 6/20 0.40
GAA P10253 6/20 0.40
GLA P06280 5/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PARP1 P09874 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
NPC1 O15118 5/20 0.38
HSD17B10 Q99714 3/20 0.38
HPGD P15428 3/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
RAB9A P51151 4/20 0.37
MEN1 O00255 3/20 0.37

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
SCHEMBL23917313 0.89 KDM4E (0.37) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL23917356 0.87 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL23917140 0.83 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL21622658 0.82 KDM4E (0.45) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL17189893 0.81 KDM4E (0.41) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL17189915 0.80 KDM4E (0.47) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL21622982 0.80 ALDH1A1 (0.43) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL23917135 0.80 KDM4E (0.41) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL23917292 0.79 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1GAA
SCHEMBL21622738 0.79 ALDH1A1 (0.36) KDM4EATML3MBTL1ALDH1A1GAA

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-11581497-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-02-14 US disclosed
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-10-14 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-11581497-B2 Materials for organic electroluminescent devices OR10J3, EPCAM, L1CAM KDM4E 2132/4885ATM 3016/4885L3MBTL1 1397/4885
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM KDM4E 2132/4885ATM 3016/4885L3MBTL1 1397/4885

“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.