SCHEMBL8422673

SCHEMBL8422673

CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CTSK P43235 11/20 0.39
CTSS P25774 6/20 0.39
CYP2D6 P10635 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CNR2 P34972 1/20 0.37
GABRB1 P18505 1/20 0.36
GABRB2 P47870 1/20 0.36
APLNR P35414 1/20 0.36

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
SCHEMBL1174310 1.00 CA1 (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL1176007 0.85 CA1 (0.47) CA1CA2CA7CTSKCTSS
SCHEMBL4293013 0.85 CA1 (0.47) CA1CA2CA7CTSKCTSS
SCHEMBL1176010 0.85 CA1 (0.47) CA1CA2CA7CTSKCTSS
SCHEMBL15776181 0.84 CA1 (0.42) CA1CA2CA7CTSKCTSS
SCHEMBL7897117 0.82 CA1 (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL23722683 0.81 CA1 (0.43) CA1CA2CA7CTSKCTSS
SCHEMBL1174518 0.81 CA1 (0.43) CA1CA2CA7CTSKCTSS
SCHEMBL18211559 0.80 CA1 (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL17073040 0.80 CA12 (0.42) CA1CA2CA7CTSKCTSS

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
EP-0740655-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1999-10-20 EP disclosed