SCHEMBL7770027

SCHEMBL7770027

CC(C)CC(NC(=O)OCCl)C([NH])=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.40
CTSS P25774 4/20 0.40
CTSL P07711 3/20 0.40
CTSB P07858 3/20 0.40
FOLH1 Q04609 5/20 0.38
ALDH1A1 P00352 2/20 0.38
TYR P14679 1/20 0.36
MME P08473 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 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
SCHEMBL7769886 0.84 CTSK (0.41) CTSKCTSSCTSLCTSBFOLH1
SCHEMBL4073412 0.84 ALDH1A1 (0.56) CTSKFOLH1ALDH1A1TYRMME
SCHEMBL22341332 0.84 ALDH1A1 (0.56) CTSKFOLH1ALDH1A1TYRMME
SCHEMBL7770030 0.83 KCNA5 (0.40) CTSKCTSSCTSLCTSBFOLH1
SCHEMBL7765999 0.82 CTSK (0.33) CTSKCTSS
SCHEMBL7771100 0.82 CTSL (0.43) CTSKCTSSCTSLCTSBFOLH1
SCHEMBL31463591 0.81 PPID (0.46) CTSKFOLH1TYR
SCHEMBL12987679 0.81 PPID (0.46) CTSKFOLH1TYR
SCHEMBL7769372 0.79 CAPN1 (0.42) CTSKCTSSCTSLCTSBFOLH1
SCHEMBL7770108 0.78 TYR (0.34) TYRLMNA

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-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed