SCHEMBL23039561

SCHEMBL23039561

c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccc(-c6nc(-c7cccc8c7sc7ccccc78)nc(-c7cccc8c7sc7ccccc78)n6)cc5)c4ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PRKDC P78527 4/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
PARP14 Q460N5 1/20 0.33
HSD17B10 Q99714 1/20 0.32
PDE1B Q01064 1/20 0.31
PDE3A Q14432 1/20 0.31
PDE11A Q9HCR9 1/20 0.31
HTT P42858 1/20 0.30
PAX8 Q06710 1/20 0.30
POLB P06746 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30

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
SCHEMBL25964890 0.99 ALOX5 (0.39) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL23602137 0.94 ALOX5 (0.37) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL19769813 0.94 ALOX5 (0.36) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL16811575 0.94 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL16811225 0.93 ALOX5 (0.39) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL16811147 0.92 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24154394 0.92 ALOX5 (0.37) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24802410 0.91 KDM4E (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24152644 0.91 ALOX5 (0.42) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24152104 0.91 ALOX5 (0.36) ALOX5KDM4EATML3MBTL1PRKDC

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-20210066613-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2021-03-04 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-20210066613-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, CYBA, NDUFV3 ALOX5 588/4885KDM4E 4617/4885ATM 2079/4885

“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.