SCHEMBL660381

SCHEMBL660381

CCCCc1cc2ccc3cccc4ccc(c1Br)c2c34

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 2/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
TLR8 Q9NR97 2/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
PTPN1 P18031 1/20 0.33
KDM4E B2RXH2 3/20 0.33

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
SCHEMBL2177707 0.84 MEN1 (0.47) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL11692367 0.83 HPGD (0.44) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL29743239 0.80 MEN1 (0.63) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL719581 0.80 MEN1 (0.63) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL27951348 0.80 ALDH1A1 (0.43) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL8225761 0.80 MEN1 (0.46) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL30345548 0.79 KMT2A (0.44) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL660380 0.79 ALDH1A1 (0.43) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL1024836 0.79 CYP3A4 (0.43) MEN1KMT2ACYP1A2ERBB2FYN
SCHEMBL28874770 0.78 MEN1 (0.43) MEN1KMT2ACYP1A2ERBB2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447333-A Pyrenyl blue light material capable of emitting in narrow band, and preparation method and application thereof 广东工业大学 2024-01-26 CN claimed
CN-117447333-A Pyrenyl blue light material capable of emitting in narrow band, and preparation method and application thereof 广东工业大学 2024-01-26 CN disclosed
CN-101410356-B Novel compound and organic light emitting device using the same CANON KK 2013-08-07 CN disclosed
US-8384286-B2 Compound and organic light emitting device using the compound CANON KABUSHIKI KAISHA (JP) 2013-02-26 US disclosed
US-20120043535-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2012-02-23 US disclosed
US-8072136-B2 Compound and organic light emitting device using the compound CANON KABUSHIKI KAISHA (JP) 2011-12-06 US disclosed
EP-2004580-B1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KK (JP) 2011-05-25 EP disclosed
US-20100176716-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2010-07-15 US disclosed
EP-2004580-A4 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KK (JP) 2009-07-15 EP disclosed
CN-101410356-A Novel compound and organic light emitting device using the same CANON KK (JP) 2009-04-15 CN disclosed
EP-2004580-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND Canon Kabushiki Kaisha (JP) 2008-12-24 EP disclosed
WO-2007114038-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2007-10-11 WO 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-20100176716-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND KCNK9, TRPA1, KCNK10 MEN1 1960/4885KMT2A 1071/4885CYP1A2 74/4885

“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.