SCHEMBL17524786

SCHEMBL17524786

c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-n3c4ccccc4c4c5sc6ccccc6c5ccc43)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
ALOX5 P09917 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
SCHEMBL23259281 0.98 PRKDC (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL16811459 0.95 PRKDC (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL19239451 0.93 PRKDC (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL24218011 0.93 PRKDC (0.35) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL23339102 0.92 PRKDC (0.38) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL24218010 0.92 PRKDC (0.33) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL22893868 0.92 PRKDC (0.30) PRKDC
SCHEMBL16810899 0.91 PRKDC (0.34) PRKDCPIK3CDPIK3CBALOX5
SCHEMBL25134246 0.90 PRKDC (0.32) PRKDCALOX5
SCHEMBL27253183 0.90 PRKDC (0.32) PRKDCALOX5

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
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
WO-2016023608-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-02-18 WO 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 PRKDC 2562/4885PIK3CD 3541/4885PIK3CB 3919/4885

“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.