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Sugi Predict / Compounds / SCHEMBL19993318

SCHEMBL19993318

SCHEMBL19993318

CC(C)C(C)(C)C(C=O)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 12/20 0.49
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CYP2D6 P10635 1/20 0.41
▸ CTSS P25774 3/20 0.40
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL22749258 0.85 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL806058 0.85 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL3688912 0.83 CTSK (0.50) CTSKCA1CA2CA7CYP2D6
SCHEMBL9906584 0.83 CTSK (0.50) CTSKCA1CA2CA7CYP2D6
SCHEMBL963465 0.79 CTSK (0.53) CTSKCA1CA2CA7CYP2D6
SCHEMBL327825 0.79 CTSK (0.53) CTSKCA1CA2CA7CYP2D6
SCHEMBL2058674 0.79 CTSK (0.53) CTSKCA1CA2CA7CYP2D6
SCHEMBL13365447 0.76 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL7148686 0.76 CA1 (0.55) CTSKCA1CA2CA7CYP2D6
SCHEMBL1991719 0.76 CA1 (0.51) CTSKCA1CA2CA7CYP2D6

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-3296295-A1 COMPOSITIONS AND METHODS FOR TREATING BETA-AMYLOID RELATED DISEASES American Life Science Pharmaceuticals, Inc. (US) 2018-03-21 — — EP disclosed