SCHEMBL5028310

SCHEMBL5028310

c1ccc2c(c1)oc1c(-n3c4ccc(-c5cccc6c5oc5ccc(-n7c8cccnc8c8ncccc87)cc56)cc4c4ncccc43)cccc12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
PRKDC P78527 2/20 0.36
GGPS1 O95749 1/20 0.35
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 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
SCHEMBL5029887 0.97 ALOX5 (0.36) ALOX5PRKDCGGPS1
SCHEMBL14949491 0.91 ALOX5 (0.32) ALOX5
SCHEMBL12925698 0.91 ALOX5 (0.39) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL5028299 0.89 MAPK14 (0.32) ALOX5PRKDC
SCHEMBL16919802 0.88 MAPK14 (0.32) ALOX5PRKDC
SCHEMBL14849210 0.88 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL5028288 0.88 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL5029690 0.88 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL10092199 0.88 ALOX5 (0.47) ALOX5PRKDCGGPS1PRMT5WDR77
SCHEMBL17264912 0.88 TSHR (0.32) NPC1MAPT

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-20130119360-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, NEW COMPOUND FOR THE SAME, DISPLAY DEVICE AND LIGHTING DEVICE USING THE SAME MERCK PATENT GMBH (DE) 2013-05-16 US disclosed
US-8367224-B2 Organic electroluminescence element, new compound for the same, display device and lighting device using the same KONICA MINOLTA HOLDINGS, INC. (JP) 2013-02-05 US disclosed
EP-2453496-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, NOVEL COMPOUND, LIGHTING DEVICE AND DISPLAY DEVICE Konica Minolta Holdings, Inc. (JP) 2012-05-16 EP disclosed
US-20110006670-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, NEW COMPOUND FOR THE SAME, DISPLAY DEVICE AND LIGHTING DEVICE USING THE SAME KONICA MINOLTA HOLDINGS, INC. (JP) 2011-01-13 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-20110006670-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, NEW COMPOUND FOR THE SAME, DISPLAY DEVICE AND LIGHTING DEVICE USING THE SAME AOC2, AOC3, CDYL ALOX5 855/4885PRKDC 3081/4885GGPS1 2906/4885

“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.