SCHEMBL13634127

SCHEMBL13634127

CCCCc1ccc2c(c1)c1cc(CCCC)ccc1n2-c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORA P35398 2/20 0.35
RORC P51449 2/20 0.35
RORB Q92753 2/20 0.35
PDK2 Q15119 2/20 0.33
PLA2G4A P47712 1/20 0.33
GPR3 P46089 1/20 0.32
PGR P06401 2/20 0.31
MCHR2 Q969V1 1/20 0.31
PSMB5 P28074 1/20 0.30
EP300 Q09472 1/20 0.30
KAT2A Q92830 1/20 0.30
KAT2B Q92831 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
SCHEMBL12560036 0.97 PLA2G4A (0.35) RORARORCRORBPDK2PLA2G4A
SCHEMBL12560185 0.95 PLA2G4A (0.33) RORARORCRORBPDK2PLA2G4A
SCHEMBL13634126 0.94 PDK2 (0.39) PDK2PLA2G4A
SCHEMBL12560141 0.93 PDK2 (0.35) RORARORCRORBPDK2GPR3
SCHEMBL12560010 0.92 KDM4E (0.33) RORARORCRORBPDK2PLA2G4A
SCHEMBL13634083 0.91 PDK2 (0.38) PDK2PLA2G4A
SCHEMBL13634065 0.90 PDK2 (0.37) RORARORCRORBPDK2PLA2G4A
SCHEMBL13634120 0.87 PDK2 (0.41) PDK2PLA2G4A
SCHEMBL12560032 0.87 PDK2 (0.36) RORARORCRORBPDK2PLA2G4A
SCHEMBL13634082 0.86 PDK2 (0.39) PDK2PLA2G4AMCHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9548457-B2 Spirofluorene derivative, material for light-emitting element, light-emitting element, light-emitting device, and electronic device SEMICONDUCTOR ENERGY LABORATORIES CO., LTD. (JP) 2017-01-17 US disclosed
US-9548457-B2 Spirofluorene derivative, material for light-emitting element, light-emitting element, light-emitting device, and electronic device SEMICONDUCTOR ENERGY LABORATORIES CO., LTD. (JP) 2017-01-17 US disclosed
US-20160087209-A1 SPIROFLUORENE DERIVATIVE, MATERIAL FOR LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2016-03-24 US disclosed
US-20160087209-A1 SPIROFLUORENE DERIVATIVE, MATERIAL FOR LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2016-03-24 US disclosed
US-8304094-B2 High light efficincy; hole transporting substance; phosphorescence SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-11-06 US disclosed
US-8304094-B2 High light efficincy; hole transporting substance; phosphorescence SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-11-06 US disclosed
WO-2008105349-A1 LIGHT-EMITTING ELEMENT USING SPIROFLUORENE DERIVATIVE AND ELECTRONIC APPLIANCE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-09-04 WO disclosed
US-20080206598-A1 Light-emitting element using spirofluorene derivative and electronic appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-08-28 US disclosed
US-20080206598-A1 Light-emitting element using spirofluorene derivative and electronic appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-08-28 US disclosed
WO-2007043354-A9 SPIROFLUORENE DERIVATIVE, MATERIAL FOR LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2007-06-07 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-20160087209-A1 SPIROFLUORENE DERIVATIVE, MATERIAL FOR LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE GRK1, PTGER2, PTGER1 RORA 247/4885RORC 955/4885RORB 519/4885

“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.