SCHEMBL7769991

SCHEMBL7769991

[NH]C(=O)CNC(=O)OCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL28096910 0.81 HTT (0.46) HTTNPC1RAB9ASMN1; SMN2
SCHEMBL7770042 0.81 HTT (0.39) HTT
SCHEMBL7769996 0.80 HTT (0.42) HTTNPC1RAB9ASMN1; SMN2
SCHEMBL24687424 0.79 HTT (0.48) HTTNPC1RAB9ASMN1; SMN2
SCHEMBL7773702 0.78 ACHE (0.38) HTTSMN1; SMN2
SCHEMBL1783247 0.77 HTT (0.46) HTTNPC1RAB9ASMN1; SMN2
SCHEMBL7769630 0.77 ALDH1A1 (0.37) HTTSMN1; SMN2
SCHEMBL29362788 0.76 HTT (0.42) HTTSMN1; SMN2
SCHEMBL967570 0.75 HTT (0.45) HTTNPC1RAB9ASMN1; SMN2
SCHEMBL25447803 0.73 MEN1 (0.48) HTTSMN1; SMN2

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