SCHEMBL20152872

SCHEMBL20152872

C=C(C)C(=O)OC1CCCCC1C(O)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL75101 0.89 PDK1 (0.30) PDK1PDK2PDK3PDK4
SCHEMBL24383568 0.89 PDK1 (0.30) PDK1PDK2PDK3PDK4
SCHEMBL15470600 0.88 PDK1 (0.33) PDK1PDK2PDK3PDK4
SCHEMBL13875281 0.86
SCHEMBL28283993 0.86 ALDH1A1 (0.31) ALDH1A1
SCHEMBL12791893 0.84 ALDH1A1 (0.32) ALDH1A1
SCHEMBL14182202 0.82
SCHEMBL9794775 0.82 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18253578 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL18841502 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180134860-A1 STRETCHABLE FILM, METHOD FOR FORMING THE SAME, STRETCHABLE WIRING FILM, AND METHOD FOR MANUFACTURING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-17 US disclosed
US-20180134860-A1 STRETCHABLE FILM, METHOD FOR FORMING THE SAME, STRETCHABLE WIRING FILM, AND METHOD FOR MANUFACTURING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-17 US disclosed