SCHEMBL6852364

SCHEMBL6852364

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

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 11/20 0.81
MMP1 P03956 11/20 0.68
MMP3 P08254 8/20 0.68
MMP2 P08253 8/20 0.68
MMP8 P22894 5/20 0.60
MMP9 P14780 5/20 0.60
MMP7 P09237 4/20 0.60
ADAM17 P78536 2/20 0.60
MMP12 P39900 1/20 0.60
MMP13 P45452 1/20 0.60
MMP14 P50281 1/20 0.60
HDAC3 O15379 1/20 0.55
HDAC4 P56524 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC8 Q9BY41 1/20 0.55

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 0.90 FCER2 (0.68) FCER2MMP1MMP3MMP2MMP8
SCHEMBL7406329 0.90 MMP1 (0.80) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6852647 0.90 FCER2 (0.77) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6851903 0.90 FCER2 (1.00) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6851738 0.88 MMP1 (0.66) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6851741 0.84 FCER2 (0.80) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6851850 0.84 FCER2 (0.61) FCER2MMP1MMP3MMP2MMP8
SCHEMBL22652874 0.82 MMP1 (0.68) FCER2MMP1MMP3MMP2MMP8
SCHEMBL6852613 0.82 FCER2 (0.74) FCER2MMP1MMP3MMP9
SCHEMBL15505966 0.81 MMP1 (1.00) FCER2MMP1MMP3MMP2MMP8

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