SCHEMBL7773705

SCHEMBL7773705

NC(=O)CCCNC(=O)OCC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.39
HTT P42858 2/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PRKACA P17612 1/20 0.33

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
SCHEMBL7769633 0.95 MAOA (0.40) ACHEHTTMAOAMAOBALDH1A1
SCHEMBL7770044 0.91 HTT (0.39) ACHEHTTMAOAMAOB
SCHEMBL25447803 0.85 MEN1 (0.48) ACHEHTTALDH1A1POLBSMN1; SMN2
SCHEMBL7773702 0.84 ACHE (0.38) ACHEHTTALDH1A1POLBSMN1; SMN2
SCHEMBL12097015 0.80 ACHE (0.63) ACHE
SCHEMBL7769996 0.79 HTT (0.42) HTTMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL14001450 0.79 HTT (0.42) ACHEHTTMAOBALDH1A1POLB
SCHEMBL7769630 0.79 ALDH1A1 (0.37) ACHEHTTALDH1A1POLBSMN1; SMN2
SCHEMBL11970037 0.77 EPHX1 (0.59) ACHE
SCHEMBL12096945 0.77 EPHX1 (0.59) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1077110-C 13-substituted milbemycin 5-oxime derivatives their preparation and their use against insects and other pests SANKYO CO (JP) 2002-01-02 CN disclosed
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
CN-1153177-A 13-substituted milbemycin 5-oxime derivatives their preparation and their use against insects and other pests SANKYO CO (JP) 1997-07-02 CN 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