SCHEMBL26568307

SCHEMBL26568307

Cc1cc(C)cc(-c2c(F)c(F)c(-c3c(F)c(F)c([B-](c4c(F)c(F)c(-c5c(F)c(F)c(-c6cc(C)cc(C(F)(F)F)c6)c(F)c5F)c(F)c4F)(c4c(F)c(F)c(-c5c(F)c(F)c(-c6cc(C)cc(C(F)(F)F)c6)c(F)c5F)c(F)c4F)c4c(F)c(F)c(-c5c(F)c(F)c(-c6cc(C(F)(F)F)cc(C(F)(F)F)c6)c(F)c5F)c(F)c4F)c(F)c3F)c(F)c2F)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.37
NOTUM Q6P988 1/20 0.37
RAPGEF4 Q8WZA2 2/20 0.34
TDP1 Q9NUW8 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
PGK1 P00558 1/20 0.30
PGK2 P07205 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
SCHEMBL17570537 0.84 NOTUM (0.44) IKBKBNOTUMRAPGEF4RXRARXRB
SCHEMBL26375581 0.79 NOTUM (0.41) IKBKBNOTUMRAPGEF4RXRARXRB
SCHEMBL26568305 0.78 KIF11 (0.40)
SCHEMBL24254767 0.76 IKBKB (0.41) IKBKBNOTUMRAPGEF4TDP1RXRA
SCHEMBL26375583 0.74 NOTUM (0.43) IKBKBNOTUMRAPGEF4TDP1
SCHEMBL17555046 0.74 IKBKB (0.43) IKBKBTDP1RXRARXRB
SCHEMBL26375464 0.74 NOTUM (0.50) IKBKBNOTUMRAPGEF4RXRARXRB
SCHEMBL13949153 0.72 NOTUM (0.49) IKBKBNOTUMRAPGEF4RXRARXRB
SCHEMBL24254714 0.70 RXRA (0.41) IKBKBTDP1RXRARXRB
SCHEMBL12583263 0.70 RAPGEF4 (0.48) IKBKBNOTUMRAPGEF4RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11793069-B2 Electron-accepting compound and composition for charge-transporting film, and luminescent element using same MITSUBISHI CHEMICAL CORPORATION (JP) 2023-10-17 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-11793069-B2 Electron-accepting compound and composition for charge-transporting film, and luminescent element using same SLC26A3, SLC6A19, SLC29A1 IKBKB 4798/4885NOTUM 4079/4885RAPGEF4 1693/4885

“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.