SCHEMBL503225

SCHEMBL503225

FC(F)(F)c1ccc(Nc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
TSHR P16473 2/20 0.62
HSD17B10 Q99714 2/20 0.62
ALOX12 P18054 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
ALOX15 P16050 1/20 0.62
PTGS1 P23219 1/20 0.62
SLC6A2 P23975 1/20 0.62
MAPK1 P28482 1/20 0.62
PTGS2 P35354 1/20 0.62
HTR2B P41595 1/20 0.62
MEN1 O00255 3/20 0.56
MAPT P10636 3/20 0.56
KMT2A Q03164 3/20 0.56
KDM4E B2RXH2 1/20 0.56
GAA P10253 1/20 0.56
GFER P55789 1/20 0.56
KIF11 P52732 2/20 0.56
KCNH3 Q9ULD8 1/20 0.56

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
Hydrochloric Acid SCHEMBL2846563 0.98 ALDH1A1 (0.59) ALDH1A1L3MBTL1TSHRHSD17B10ALOX12
Fluoride SCHEMBL8754786 0.98 ALDH1A1 (0.59) ALDH1A1L3MBTL1TSHRHSD17B10ALOX12
Diphenylamine SCHEMBL31175856 0.93 ALDH1A1 (0.70) ALDH1A1L3MBTL1TSHRHSD17B10ALOX12
SCHEMBL1921455 0.90 EPHX2 (0.56) ALDH1A1TSHRTDP1MEN1KMT2A
SCHEMBL394422 0.90 EPHX2 (0.56) ALDH1A1TSHRTDP1MEN1KMT2A
SCHEMBL2925673 0.86 ALDH1A1 (0.59) ALDH1A1L3MBTL1TSHRTDP1PTGS1
SCHEMBL24287396 0.85 KIF11 (0.57) ALDH1A1L3MBTL1TSHRHSD17B10ALOX12
SCHEMBL1921457 0.84 ALDH1A1 (0.55) ALDH1A1L3MBTL1TSHRTDP1MEN1
SCHEMBL1921452 0.83 KIF11 (0.68) KIF11EPHX2
SCHEMBL17115744 0.82 NPC1 (0.81) PTGS1MEN1MAPTKMT2ARAB9A

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 337 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114671888-B Organic compound, organic light-emitting element, display device, photoelectric conversion device, electronic device, illumination device, and exposure light source 佳能株式会社 2024-05-03 CN claimed
EP-2379473-B1 DIACENAPHTHO[1,2-B:1',2'-K]CHRYSENE DERIVATIVE CANON KK (JP) 2017-02-22 EP claimed
CN-118302428-A Organic compound and organic light-emitting device 佳能株式会社 2024-07-05 CN disclosed
CN-118303146-A Organic light emitting device 佳能株式会社 2024-07-05 CN disclosed
WO-2024142881-A1 METAL COMPLEX AND ORGANIC ELECTROLUMINESCENT ELEMENT キヤノン株式会社 2024-07-04 WO disclosed
CN-118265686-A Organic compound, organic light-emitting element, display device, photoelectric conversion device, electronic device, illumination device, moving body, and exposure light source 佳能株式会社 2024-06-28 CN disclosed
US-20240206317-A1 ORGANIC METAL COMPLEX AND ORGANIC LIGHT EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2024-06-20 US disclosed
WO-2024116908-A1 ORGANOMETALLIC COMPLEX AND ORGANIC LIGHT EMITTING ELEMENT キヤノン株式会社 2024-06-06 WO disclosed
CN-114456188-B Organic compound and organic light-emitting device 佳能株式会社 2024-05-31 CN disclosed
CN-118103381-A Organic compound and organic light-emitting device 佳能株式会社 2024-05-28 CN disclosed
US-20240172553-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2024-05-23 US disclosed
US-20060125378-A1 Aminoanthryl derivative substitution compound and organic electroluminescence device using the same CANON KABUSHIKI KAISHA (JP) 2006-06-15 US disclosed
US-20060121312-A1 Fluorene compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2006-06-08 US disclosed
US-20060113528-A1 Organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2006-06-01 US disclosed
US-20060115678-A1 Aminoanthryl derivative-substituted pyrene compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2006-06-01 US disclosed
US-20050099115-A1 Substituted anthryl derivative and electoluminescence device using the same CANON KABUSHIKI KAISHA (JP) 2005-05-12 US disclosed
WO-2005000787-A1 AMINOANTHRYL DERIVATIVE SUBSTITUTION COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2005-01-06 WO disclosed
US-20040263067-A1 Anthryl derivative group substituted compound, and organic luminescent device making use of same CANON KABUSHIKI KAISHA (JP) 2004-12-30 US disclosed
US-20040265632-A1 Organic electroluminescent device CANON KABUSHIKI KAISHA (JP) 2004-12-30 US disclosed
US-4117167-A INSECTICIDES, ACARICIDES IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1978-09-26 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 (7 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-20060121312-A1 Fluorene compound and organic light-emitting device LEF1, AFF1, FLI1 ALDH1A1 160/4885L3MBTL1 1036/4885TSHR 1368/4885
US-20060125378-A1 Aminoanthryl derivative substitution compound and organic electroluminescence device using the same ALAD, TYR, DDC ALDH1A1 284/4885L3MBTL1 800/4885TSHR 4020/4885
US-20050099115-A1 Substituted anthryl derivative and electoluminescence device using the same ALAD, ERAL1, LAGE3 ALDH1A1 308/4885L3MBTL1 814/4885TSHR 2029/4885
US-20240206317-A1 ORGANIC METAL COMPLEX AND ORGANIC LIGHT EMITTING ELEMENT ORC3, CRY1, PER2 ALDH1A1 2817/4885L3MBTL1 1095/4885TSHR 3979/4885
US-20240172553-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT NOM1, L1CAM, AP2M1 ALDH1A1 394/4885L3MBTL1 34/4885TSHR 4074/4885
US-20060115678-A1 Aminoanthryl derivative-substituted pyrene compound and organic light-emitting device ALAD, PAH, PPOX ALDH1A1 697/4885L3MBTL1 869/4885TSHR 4167/4885
US-20040263067-A1 Anthryl derivative group substituted compound, and organic luminescent device making use of same ALAD, AAAS, NLRP1 ALDH1A1 1014/4885L3MBTL1 768/4885TSHR 4384/4885

“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.