SCHEMBL5028248

SCHEMBL5028248

c1ccc(-n2c3cccnc3c3ncccc32)c(-c2ccc3oc4c(-n5c6cccnc6c6ncccc65)cccc4c3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 1/20 0.34
PDE4D Q08499 2/20 0.33
MAPT P10636 4/20 0.33
LMNA P02545 3/20 0.33
TSHR P16473 3/20 0.33
HTT P42858 2/20 0.33
IDO1 P14902 1/20 0.33
ACVR1 Q04771 2/20 0.32
GGPS1 O95749 1/20 0.32
NPC1 O15118 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL12925750 0.91 ALOX5 (0.33) ALOX5PRKDCMAPT
SCHEMBL12925621 0.88 ALOX5 (0.44) ALOX5PRKDCMAPTGGPS1NPC1
SCHEMBL5029887 0.88 ALOX5 (0.36) ALOX5PRKDCGGPS1
SCHEMBL5028310 0.87 ALOX5 (0.41) ALOX5PRKDCMAPTGGPS1NPC1
SCHEMBL12925817 0.85 PDE4D (0.33) PDE4DMAPTLMNATSHRHTT
SCHEMBL10038545 0.85 MAPK14 (0.34) ALOX5PRKDC
SCHEMBL9890329 0.84 PDE4D (0.36) ALOX5PDE4DMAPTLMNATSHR
SCHEMBL5028300 0.84 KDM4E (0.35) MAPTLMNATSHRHTTMEN1
SCHEMBL5028299 0.84 MAPK14 (0.32) ALOX5PRKDC
SCHEMBL16919802 0.83 MAPK14 (0.32) ALOX5PRKDC

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 2 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
EP-2453496-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, NOVEL COMPOUND, LIGHTING DEVICE AND DISPLAY DEVICE Konica Minolta Holdings, Inc. (JP) 2012-05-16 EP disclosed