SCHEMBL19239356

SCHEMBL19239356

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6cccc7c6sc6ccccc67)ccc54)cc3)nc(-c3cccc4sc5ccccc5c34)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
PRKDC P78527 2/20 0.34
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LIMK1 P53667 1/20 0.31
PTGER4 P35408 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
SCHEMBL27021373 0.95 ALOX5 (0.40) ALOX5PRKDCLIMK1
SCHEMBL22258116 0.94 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23947815 0.94 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL17252462 0.93 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL11998294 0.93 ALOX5 (0.47) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL22257846 0.93 ALOX5 (0.42) ALOX5PRKDCLIMK1
SCHEMBL20754194 0.92 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL22023822 0.92 ALOX5 (0.37) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15786089 0.92 ALOX5 (0.46) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL22257719 0.92 ALOX5 (0.40) ALOX5PRKDCLIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9876181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-01-23 US disclosed
US-9876181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-01-23 US disclosed
US-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-08-17 US disclosed
US-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-08-17 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-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES DDT, ETFA, TST ALOX5 890/4885PRKDC 2562/4885KDM4E 1629/4885

“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.