SCHEMBL7765906

SCHEMBL7765906

CC(C)(NC(=O)OCC(F)(F)F)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
TSHR P16473 2/20 0.33
LMNA P02545 2/20 0.33
CYP3A4 P08684 1/20 0.33
NFKB1 P19838 1/20 0.33
ADRA1A P35348 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 1/20 0.32
CNR2 P34972 3/20 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
SCHEMBL7765897 0.81 HTT (0.39) HTTCNR2
SCHEMBL9547614 0.80 HTT (0.45) HTTTSHRRAB9AHSD17B10CNR2
SCHEMBL7773594 0.79 ALOX15 (0.44) HTTTSHRLMNAHSD17B10
SCHEMBL7765955 0.77
SCHEMBL7771474 0.76 SMN1; SMN2 (0.42) TSHRLMNACYP3A4NFKB1ADRA1A
SCHEMBL21680809 0.74 HTT (0.46) HTTTSHRLMNACYP3A4NFKB1
SCHEMBL4783072 0.73 ALDH1A1 (0.30)
SCHEMBL7773645 0.73 ALDH1A1 (0.48) TSHRRAB9A
SCHEMBL7769425 0.71 EPHX1 (0.33) RAB9A
SCHEMBL965595 0.71 HTT (0.48) HTTTSHRLMNANFKB1RAB9A

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