SCHEMBL2223976

SCHEMBL2223976

OCc1ccc(-c2ccc(COC(F)(F)C(F)(F)C(F)C(F)F)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.39
PDK2 Q15119 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
IDO1 P14902 4/20 0.32
AGXT P21549 2/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
MAPT P10636 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
SCHEMBL770342 0.92 IDO1 (0.36) KIF11IDO1AGXTMAPT
SCHEMBL769992 0.85 IDO1 (0.32) IDO1AGXTMAPT
SCHEMBL2223979 0.75 KIF11 (0.41) KIF11PDK2MKNK1MKNK2IDO1
SCHEMBL12805079 0.75 KIF11 (0.41) KIF11PDK2MKNK1MKNK2IDO1
SCHEMBL2223968 0.74 KIF11 (0.40) KIF11PDK2MKNK1MKNK2RXRA
SCHEMBL2223991 0.72 TACR1 (0.37)
SCHEMBL12490182 0.70 ALDH1A1 (0.39) KIF11PDK2IDO1RXRARXRB
SCHEMBL11310791 0.65 MKNK1 (0.56) KIF11PDK2MKNK1MKNK2
SCHEMBL679970 0.65 MKNK1 (0.56) KIF11PDK2MKNK1MKNK2
SCHEMBL1081720 0.65 CA1 (0.39) IDO1AGXT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516389-B1 FLUORINATED ARYLENE-CONTAINING COMPOUNDS, METHODS, AND POLYMERS PREPARED THEREFROM 3M INNOVATIVE PROPERTIES CO (US) 2016-02-17 EP disclosed
US-8975436-B2 Fluorinated arylene-containing compounds, methods, and polymers prepared therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-03-10 US disclosed
EP-2516389-A1 FLUORINATED ARYLENE-CONTAINING COMPOUNDS, METHODS, AND POLYMERS PREPARED THEREFROM 3M Innovative Properties Company (US) 2012-10-31 EP disclosed
US-20120252997-A1 FLUORINATED ARYLENE-CONTAINING COMPOUNDS, METHODS, AND POLYMERS PREPARED THEREFROM 3M INNOVATIVE PROPERTIES COMPANY 2012-10-04 US disclosed
WO-2011087717-A1 FLUORINATED ARYLENE-CONTAINING COMPOUNDS, METHODS, AND POLYMERS PREPARED THEREFROM 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-07-21 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-20120252997-A1 FLUORINATED ARYLENE-CONTAINING COMPOUNDS, METHODS, AND POLYMERS PREPARED THEREFROM WASF2, PFAS, FLI1 KIF11 1402/4885PDK2 2227/4885MKNK1 4325/4885

“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.