SCHEMBL664630

SCHEMBL664630

CCCCC1(CCCC)c2ccccc2-c2ccc(I)cc21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.39
PDK2 Q15119 8/20 0.38
ELANE P08246 1/20 0.35
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
PGR P06401 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GPR3 P46089 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31

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
SCHEMBL4632268 0.95 PDK2 (0.39) APEX1PDK2ELANEPGRCYP2C9
SCHEMBL26226755 0.94 PDK2 (0.40) APEX1PDK2ALOX12CYP2C9CYP2C19
SCHEMBL1921668 0.94 PDK2 (0.40) APEX1PDK2ALOX12CYP2C9CYP2C19
SCHEMBL1923373 0.94 PDK2 (0.40) APEX1PDK2ALOX12CYP2C9CYP2C19
SCHEMBL16622910 0.94 PDK2 (0.40) APEX1PDK2ALOX12CYP2C9CYP2C19
SCHEMBL1921532 0.92 ELANE (0.33) PDK2ELANEKDM4EPKMCYP2C9
SCHEMBL22958606 0.91 APEX1 (0.39) APEX1PDK2ELANEKDM4EPKM
SCHEMBL9781139 0.90 APEX1 (0.41) APEX1PDK2PGR
SCHEMBL4634013 0.87 MMP2 (0.33) PDK2MMP2MMP9MMP8MMP13
SCHEMBL13931289 0.86 PDK2 (0.35) APEX1PDK2ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106242938-A Fluorene ethylene derivative and synthetic method thereof 沈阳大学 2016-12-21 CN disclosed
US-20150076420-A1 Dye-Sensitized Photoelectric Conversion Element NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2015-03-19 US disclosed
EP-2833472-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION ELEMENT Nippon Kayaku Kabushiki Kaisha (JP) 2015-02-04 EP disclosed
CN-104246936-A Dye-sensitized photoelectric conversion element NIPPON KAYAKU KK 2014-12-24 CN disclosed
US-8735720-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-05-27 US disclosed
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-101421359-B Dye-sensitized photoelectric conversion device NIPPON KAYAKU KK 2013-06-26 CN disclosed
US-8419808-B2 Dye compound and photoelectric component using the same EVERLIGHT USA, INC. (US) 2013-04-16 US disclosed
EP-1990373-B1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION DEVICE NIPPON KAYAKU KK (JP) 2012-10-03 EP disclosed
US-20100122729-A1 Dye compound and photoelectric component using the same EVERLIGHT USA, INC. (US) 2010-05-20 US disclosed
US-20100122729-A1 Dye compound and photoelectric component using the same EVERLIGHT USA, INC. (US) 2010-05-20 US disclosed
US-7608680-B2 Triarylamine polymer, process for producing the same, and use thereof TOSOH CORPORATION (JP) 2009-10-27 US disclosed
CN-101421359-A Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KK (JP) 2009-04-29 CN disclosed
US-20090044857-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-19 US disclosed
EP-1990373-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION DEVICE Nippon Kayaku Kabushiki Kaisha (JP) 2008-11-12 EP 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 (2 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-20090044857-A1 Dye-Sensitized Photoelectric Conversion Device CRY1, H1-5, CHRM1 APEX1 543/4885PDK2 1306/4885ELANE 1432/4885
US-20100122729-A1 Dye compound and photoelectric component using the same CRY1, SCNN1B, SMARCC2 APEX1 2783/4885PDK2 1668/4885ELANE 2139/4885

“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.