SCHEMBL8299490

SCHEMBL8299490

CCC(NC[C@@H](N)Cc1ccccc1)C(=O)NCC(C)C

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.53
GGT1 P19440 2/20 0.52

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
SCHEMBL14388126 1.00 MMP2 (0.53) MMP2GGT1
SCHEMBL14357006 1.00 MMP2 (0.53) MMP2GGT1
SCHEMBL8301025 0.90 GGT1 (0.56) MMP2GGT1
SCHEMBL14357008 0.90 GGT1 (0.56) MMP2GGT1
SCHEMBL14388015 0.90 GGT1 (0.56) MMP2GGT1
SCHEMBL8248936 0.90 GGT1 (0.57) MMP2GGT1
SCHEMBL27810872 0.88 GGT1 (0.54) MMP2GGT1
SCHEMBL27810865 0.88 GGT1 (0.54) MMP2GGT1
SCHEMBL14357014 0.88 GGT1 (0.56) MMP2GGT1
SCHEMBL8301861 0.88 GGT1 (0.56) MMP2GGT1

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-2005004802-A2 N-ALKYL PHENYLCARBOXAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK & CO., INC. (US) 2005-01-20 WO disclosed