SCHEMBL7832809

SCHEMBL7832809

C[C@](O)(C(=O)Nc1cccc2c1C(=O)c1ccoc1CO2)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 20/20 0.44
PDK2 Q15119 20/20 0.44
PDK3 Q15120 20/20 0.44
PDK4 Q16654 20/20 0.44

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
SCHEMBL7821223 1.00 PDK1 (0.44) PDK1PDK2PDK3PDK4
SCHEMBL7821219 1.00 PDK1 (0.44) PDK1PDK2PDK3PDK4
SCHEMBL7832877 0.84 PDK1 (0.45) PDK1PDK2PDK3PDK4
SCHEMBL7831455 0.84 PDK1 (0.49) PDK1PDK2PDK3PDK4
SCHEMBL7835715 0.83 PDK1 (0.43) PDK1PDK2PDK3PDK4
SCHEMBL7832664 0.82 PDK1 (0.44) PDK1PDK2PDK3PDK4
SCHEMBL7832734 0.82 PDK1 (0.52) PDK1PDK2PDK3PDK4
SCHEMBL7832936 0.81 PDK1 (0.43) PDK1PDK2PDK3PDK4
SCHEMBL7833256 0.81 PDK1 (0.46) PDK1PDK2PDK3PDK4
SCHEMBL5766479 0.80 PDK1 (0.45) PDK1PDK2PDK3PDK4

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
EP-0798288-B1 TRICICLIC COMPOUNDS KYOWA HAKKO KOGYO KK (JP) 2001-05-16 EP disclosed
EP-0798288-A1 TRICICLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-10-01 EP disclosed