SCHEMBL667873

SCHEMBL667873

CC(C)C1(C(C)C)c2ccccc2-c2ccc(I)cc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 15/20 0.36
▸ TDP2 O95551 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRB2 P47870 1/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 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
SCHEMBL1921164 0.91 TDP2 (0.35) TDP2
SCHEMBL1921347 0.83 PDK2 (0.34) PDK2GABRA1GABRB2
SCHEMBL28199301 0.82 PDK2 (0.40) PDK2TDP2ESR1ESR2
SCHEMBL1921507 0.79 PDK2 (0.50) PDK2
SCHEMBL1920765 0.79 PDK2 (0.50) PDK2
Hydrochloric Acid SCHEMBL27969207 0.79 PDK2 (0.50) PDK2ESR1ESR2
SCHEMBL23936096 0.76 PDK2 (0.35) PDK2TDP2ESR1ESR2
SCHEMBL431200 0.76 HTR2A (0.38) PDK2TDP2ESR1ESR2
SCHEMBL29508649 0.76 HTR2A (0.38) PDK2TDP2ESR1ESR2
SCHEMBL13523410 0.75 KDM4E (0.41) PDK2TDP2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2327739-B1 Novel triarylamine polymer, process for its production and its use TOSOH CORP (JP) 2014-05-07 — — EP disclosed
EP-1528074-B1 NOVEL TRIARYLAMINE POLYMER, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF TOSOH CORP (JP) 2014-03-26 — — EP 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
CN-102629663-A Novel compound and organic light emitting device using the compound CANON KK 2012-08-08 — — CN 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-2327739-A1 Novel triarylamine polymer, process for its production and its use TOSOH CORPORATION (JP) 2011-06-01 — — EP 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
US-7608680-B2 Triarylamine polymer, process for producing the same, and use thereof TOSOH CORPORATION (JP) 2009-10-27 — — 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
US-20060241278-A1 Novel triarylamine polymer, process for producing the same, and use thereof TOSOH CORPORATION (JP) 2006-10-26 — — US disclosed
US-20060017040-A9 Novel triarylamine polymer, process for producing the same, and use thereof SUZUKI TAKAO 2006-01-26 — — US disclosed
EP-1528074-A1 NOVEL TRIARYLAMINE POLYMER, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Tosoh Corporation (JP) 2005-05-04 — — EP disclosed
US-20040262574-A1 Novel triarylamine polymer, process for producing the same, and use thereof TOSOH CORPORATION (JP) 2004-12-30 — — 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-20100176716-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE COMPOUND KCNK9, TRPA1, KCNK10 PDK2 235/4885TDP2 3258/4885GABRA1 1405/4885

“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.

Send feedback