SCHEMBL11567448

SCHEMBL11567448

CC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(=O)OCc1ccccc1)C(C)C)C(C)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.55
CTSB P07858 5/20 0.55
MMP1 P03956 1/20 0.48
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
CTSS P25774 2/20 0.46
CTSL P07711 2/20 0.46

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
SCHEMBL11569751 0.90 MMP1 (0.51) CTSKCTSBMMP1MMP9MMP8
SCHEMBL11567621 0.88 CTSK (0.55) CTSKCTSBCTSSCTSL
SCHEMBL11567622 0.88 CTSK (0.55) CTSKCTSBCTSSCTSL
SCHEMBL11567669 0.87 CTSK (0.53) CTSKCTSB
Hydrochloric Acid SCHEMBL11568557 0.87 CTSK (0.54) CTSKCTSBCTSSCTSL
Hydrochloric Acid SCHEMBL11568559 0.87 CTSK (0.54) CTSKCTSBCTSSCTSL
SCHEMBL18775048 0.82 CTSK (0.60) CTSKCTSBCTSSCTSL
SCHEMBL25634730 0.82 CTSK (0.60) CTSKCTSBCTSSCTSL
SCHEMBL11764262 0.80 CTSK (0.58) CTSKCTSBCTSSCTSL
SCHEMBL11764270 0.80 CTSK (0.58) CTSKCTSBCTSSCTSL

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
US-4146614-A TREATMENT OF SCHIZOPHRENIA STATE OF MICHIGAN (US) 1979-03-27 US disclosed