SCHEMBL7769638

SCHEMBL7769638

NC(=O)CCNC(=O)OCCCCCl

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.47
EPHX2 P34913 2/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 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
SCHEMBL7769637 0.83 ACHE (0.47) ACHEEPHX2
SCHEMBL7773720 0.82 ACHE (0.42) ACHEEPHX2CA12CA1CA2
SCHEMBL7771516 0.81 ACHE (0.62) ACHEEPHX2
SCHEMBL7773653 0.81 ACHE (0.44) ACHEEPHX2
SCHEMBL7769360 0.80 ACHE (0.35) ACHE
SCHEMBL11740011 0.77 ACHE (0.57) ACHEEPHX2
SCHEMBL7769333 0.77 ACHE (0.55) ACHE
SCHEMBL16013673 0.76 ACHE (0.60) ACHEEPHX2
SCHEMBL7771590 0.74 ACHE (0.42) ACHE
SCHEMBL8141870 0.74 ACHE (0.68) ACHEEPHX2

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