SCHEMBL20754137

SCHEMBL20754137

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3cc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)ccc34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.38
PRKDC P78527 3/20 0.38
KDM4E B2RXH2 4/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
GGPS1 O95749 1/20 0.32
GRM5 P41594 1/20 0.32
MAPT P10636 4/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CB P42338 2/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CG P48736 1/20 0.31
DUSP3 P51452 1/20 0.31
TSHR P16473 4/20 0.31
HSD17B10 Q99714 3/20 0.31
MAPK1 P28482 2/20 0.31
LMNA P02545 1/20 0.31
ALDH1A1 P00352 3/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 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
SCHEMBL21192109 0.98 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947520 0.97 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947353 0.96 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947851 0.95 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947310 0.94 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947869 0.94 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947550 0.94 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL24882795 0.94 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL21192019 0.93 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL24882945 0.93 ALOX5 (0.38) ALOX5PRKDCKDM4EGGPS1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4186898-A1 COMPOSITION FOR ORGANIC ELECTRONIC COMPOUNDS Merck Patent GmbH (DE) 2023-05-31 EP disclosed
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
US-20190058131-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2019-02-21 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 ALOX5 1694/4885PRKDC 3825/4885KDM4E 3745/4885
US-20200231578-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES SLCO2B1, SLCO2A1, SLCO1B3 ALOX5 1694/4885PRKDC 3825/4885KDM4E 3745/4885

“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.