SCHEMBL2555835

SCHEMBL2555835

CC1CC2(CCN1C(=O)OCc1ccccc1)C(O)CS(=O)(=O)N2c1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 13/20 0.43
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
SIGMAR1 Q99720 4/20 0.38
TMEM97 Q5BJF2 3/20 0.38

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
SCHEMBL2557791 1.00 BACE1 (0.43) BACE1PDK1PDK2PDK3PDK4
SCHEMBL2579667 1.00 BACE1 (0.43) BACE1PDK1PDK2PDK3PDK4
SCHEMBL14685925 0.86 BACE1 (0.41) BACE1
SCHEMBL14685948 0.86 BACE1 (0.41) BACE1
SCHEMBL2435928 0.82 PDK1 (0.40) BACE1PDK1PDK2PDK3PDK4
SCHEMBL2434394 0.82 PDK1 (0.40) BACE1PDK1PDK2PDK3PDK4
SCHEMBL2554666 0.82 BACE1 (0.43) BACE1PDK1PDK2PDK3PDK4
SCHEMBL7715536 0.82 BACE1 (0.43) BACE1PDK1PDK2PDK3PDK4
SCHEMBL2556177 0.82 BACE1 (0.43) BACE1PDK1PDK2PDK3PDK4
SCHEMBL2555754 0.81 BACE1 (0.44) BACE1PDK1PDK2PDK3PDK4

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
WO-2011125006-A2 NOVEL SULTAM COMPOUNDS PFIZER INC. (US) 2011-10-13 WO disclosed