SCHEMBL7877928

SCHEMBL7877928

C[C@H]1CC1CNc1cc(C(=O)O)cc(N(C)S(C)(=O)=O)n1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.64
KDM4D Q6B0I6 1/20 0.33

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
SCHEMBL2210760 1.00 BACE1 (0.64) BACE1KDM4D
SCHEMBL7945785 1.00 BACE1 (0.64) BACE1KDM4D
SCHEMBL4531419 1.00 BACE1 (0.64) BACE1KDM4D
SCHEMBL4509116 0.89 BACE1 (0.60) BACE1
SCHEMBL7880801 0.88 BACE1 (0.64) BACE1
SCHEMBL2210348 0.88 BACE1 (0.64) BACE1
SCHEMBL7877930 0.86 BACE1 (0.51) BACE1
SCHEMBL2028914 0.80 BACE1 (0.56) BACE1
SCHEMBL2255225 0.80 BACE1 (0.56) BACE1
SCHEMBL13269842 0.80 BACE1 (0.46) BACE1

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-2010107384-A1 ASPARTYL PROTEASE INHIBITORS MEDIVIR AB (SE) 2010-09-23 WO disclosed