SCHEMBL6851738

SCHEMBL6851738

CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCc1ccccc1)[C@H](O)C(=O)NO

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.66
MMP3 P08254 12/20 0.66
MMP2 P08253 9/20 0.66
MMP7 P09237 5/20 0.66
FCER2 P06734 5/20 0.66
MMP13 P45452 2/20 0.62
MMP9 P14780 2/20 0.61
MMP8 P22894 5/20 0.54
ADAM17 P78536 2/20 0.54
MMP12 P39900 1/20 0.54
MMP14 P50281 1/20 0.54

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
SCHEMBL6851874 0.93 FCER2 (0.68) MMP1MMP3MMP2MMP7FCER2
SCHEMBL6852364 0.88 FCER2 (0.81) MMP1MMP3MMP2MMP7FCER2
SCHEMBL7406329 0.84 MMP1 (0.80) MMP1MMP3MMP2MMP7FCER2
SCHEMBL9288857 0.80 MMP3 (1.00) MMP1MMP3MMP2MMP7FCER2
SCHEMBL6851903 0.79 FCER2 (1.00) MMP1MMP3MMP2MMP7FCER2
SCHEMBL6852647 0.79 FCER2 (0.77) MMP1MMP3MMP2MMP7FCER2
SCHEMBL8777266 0.78 MMP2 (0.81) MMP1MMP3MMP2MMP7MMP9
SCHEMBL30035567 0.77 MMP1 (1.00) MMP1MMP3MMP2MMP7FCER2
SCHEMBL3503805 0.77 MMP1 (0.76) MMP1MMP3MMP2MMP7FCER2
SCHEMBL13253276 0.77 MMP1 (0.76) MMP1MMP3MMP2MMP7FCER2

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-2011011181-A1 PHARMACOLOGICAL CHAPERONES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AMICUS THERAPEUTICS, INC. (US) 2011-01-27 WO disclosed