SCHEMBL1637147

SCHEMBL1637147

CC(C)(C)c1ccc2c(c1)-c1cccc3c(B4OC(C)(C)C(C)(C)O4)ccc-2c13

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PLA2G1B P04054 1/20 0.37
NFKB1 P19838 1/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KIF11 P52732 2/20 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
SCHEMBL15028119 1.00 NPC1 (0.37) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL2230473 0.88 NPC1 (0.32) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL30040842 0.85 KEAP1 (0.46) ALDH1A1L3MBTL1CRHBPCRHR2KEAP1
SCHEMBL29709221 0.85 KEAP1 (0.46) ALDH1A1L3MBTL1CRHBPCRHR2KEAP1
SCHEMBL961673 0.85 KEAP1 (0.46) ALDH1A1L3MBTL1CRHBPCRHR2KEAP1
SCHEMBL15028276 0.83 TRPA1 (0.35) ALDH1A1L3MBTL1CRHBPCRHR2KEAP1
SCHEMBL12200531 0.83 LIPG (0.40) CRHBPCRHR2KEAP1NFE2L2
SCHEMBL12127199 0.81 ALDH1A1 (0.43) ALDH1A1L3MBTL1CRHBPCRHR2KEAP1
SCHEMBL14820964 0.81 LPL (0.33) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL4196550 0.81 NPC1 (0.32) NPC1ALDH1A1PLA2G1BNFKB1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2665691-B1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND IMAGE DISPLAY DEVICE CANON KK (JP) 2020-02-12 EP disclosed
US-9240554-B2 Organic compound, organic electroluminescence element, and image display device CANON KABUSHIKI KAISHA (JP) 2016-01-19 US disclosed
US-9240554-B2 Organic compound, organic electroluminescence element, and image display device CANON KABUSHIKI KAISHA (JP) 2016-01-19 US disclosed
EP-2464616-B1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KK (JP) 2014-10-29 EP disclosed
US-20130300638-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND IMAGE DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 2013-11-14 US disclosed
US-20130300638-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND IMAGE DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 2013-11-14 US disclosed
WO-2012098793-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND IMAGE DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 2012-07-26 WO disclosed
US-20110148292-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-06-23 US disclosed
US-20110148292-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-06-23 US disclosed
US-7932592-B2 Exhibits a light emission color with significantly high purity , highly efficient, highly luminant, and long-lived light emission; high glass transition temperature, heat stability and superior durability CANON KABUSHIKI KAISHA (JP) 2011-04-26 US disclosed
WO-2011018886-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-02-17 WO disclosed
US-20100123390-A1 LIGHT-EMITTING DEVICE, IMAGE DISPLAY APPARATUS, AND NOVEL ORGANIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2010-05-20 US disclosed
US-20100123390-A1 LIGHT-EMITTING DEVICE, IMAGE DISPLAY APPARATUS, AND NOVEL ORGANIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2010-05-20 US disclosed
US-20080124577-A1 Exhibits a light emission color with significantly high purity , highly efficient, highly luminant, and long-lived light emission; high glass transition temperature, heat stability and superior durability CANON KABUSHIKI KAISHA (JP) 2008-05-29 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 (3 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-20100123390-A1 LIGHT-EMITTING DEVICE, IMAGE DISPLAY APPARATUS, AND NOVEL ORGANIC COMPOUND OCIAD1, OCIAD2, OR51E2 NPC1 1455/4885ALDH1A1 163/4885PLA2G1B 4133/4885
US-20110148292-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME RPS24, OR10J3, ORC3 NPC1 2584/4885ALDH1A1 600/4885PLA2G1B 4562/4885
US-20080124577-A1 Exhibits a light emission color with significantly high purity , highly efficient, highly luminant, and long-lived light emission; high glass transition temperature, heat stability and superior durability LEF1, MAP1LC3A, HSF1 NPC1 3297/4885ALDH1A1 726/4885PLA2G1B 3369/4885

“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.