SCHEMBL7518207

SCHEMBL7518207

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
RNPEP Q9H4A4 1/20 0.38
SLC7A5 Q01650 1/20 0.38
NPSR1 Q6W5P4 4/20 0.36
TDP1 Q9NUW8 3/20 0.36
POLB P06746 3/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
GAA P10253 1/20 0.35
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 1/20 0.34
MAPT P10636 5/20 0.34
ALDH1A1 P00352 3/20 0.34

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
SCHEMBL7518209 1.00 CTSL (0.39) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL15015766 1.00 CTSL (0.39) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7762836 1.00 CTSL (0.39) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL6947125 0.88 CTSK (0.35) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7838360 0.88 CTSK (0.35) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7838358 0.88 CTSK (0.35) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7838363 0.88 CTSK (0.35) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL27450608 0.88 CTSK (0.35) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7765816 0.87 CTSL (0.38) CTSLCTSBCTSSCTSKRNPEP
SCHEMBL7525465 0.87 CTSL (0.38) CTSLCTSBCTSSCTSKRNPEP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP disclosed
EP-1101492-A1 NOVEL REMEDIES FOR ALLERGIC DISEASES FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2001-05-23 EP disclosed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed