SCHEMBL5028173

SCHEMBL5028173

c1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4c(-n5c6ccccc6c6cc(-c7cccc8c7oc7ccc(-n9c%10ccccc%10c%10ccccc%109)cc78)ccc65)cccc4c3c2)c2oc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
PRKDC P78527 2/20 0.38
GGPS1 O95749 1/20 0.36
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGES2 Q9H7Z7 1/20 0.32
PTPRF P10586 1/20 0.30
PTPN2 P17706 1/20 0.30
PTPN1 P18031 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
SCHEMBL10092187 1.00 ALOX5 (0.43) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL10092199 0.98 ALOX5 (0.47) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL5028288 0.98 ALOX5 (0.47) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL14849210 0.98 ALOX5 (0.47) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL5029690 0.98 ALOX5 (0.47) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL12925677 0.96 ALOX5 (0.40) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL5028289 0.92 ALOX5 (0.41) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL5030361 0.91 ALOX5 (0.46) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL20654715 0.91 ALOX5 (0.42) ALOX5PRKDCGGPS1EDNRBEDNRA
SCHEMBL10038530 0.91 ALOX5 (0.43) ALOX5PRKDCGGPS1EDNRBEDNRA

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-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
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.