SCHEMBL7770044

SCHEMBL7770044

NC(=O)CCNC(=O)OCC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
ACHE P22303 8/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
PRSS1 P07477 1/20 0.31
TPSAB1 Q15661 1/20 0.31

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
SCHEMBL7773705 0.91 ACHE (0.39) HTTACHEMAOAMAOB
SCHEMBL7769633 0.89 MAOA (0.40) HTTACHEMAOAMAOB
SCHEMBL7770042 0.81 HTT (0.39) HTTACHE
SCHEMBL14001450 0.81 HTT (0.42) HTTACHEMAOB
SCHEMBL7769996 0.81 HTT (0.42) HTTMAOAMAOB
SCHEMBL25447803 0.79 MEN1 (0.48) HTTACHE
SCHEMBL12223162 0.77 ACHE (0.47) HTTACHE
SCHEMBL29362788 0.77 HTT (0.42) HTTACHE
SCHEMBL24687424 0.76 HTT (0.48) HTTACHE
SCHEMBL7773702 0.75 ACHE (0.38) HTTACHE

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