SCHEMBL7770879

SCHEMBL7770879

[NH]C(=O)CCCCCCNC(=O)OCCl

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ACHE P22303 13/20 0.41
KMT2A Q03164 1/20 0.40
EPHX1 P07099 1/20 0.39
EPHX2 P34913 2/20 0.38
PRMT1 Q99873 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
SCHEMBL7770969 1.00 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2ACHEKMT2AEPHX1
SCHEMBL7769453 0.98 ACHE (0.40) ALDH1A1SMN1; SMN2ACHEKMT2AEPHX1
SCHEMBL7771589 0.93 ACHE (0.41) ALDH1A1SMN1; SMN2ACHEEPHX1
SCHEMBL7769356 0.85 ACHE (0.35) ACHE
SCHEMBL7770881 0.84 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ACHEKMT2AEPHX1
SCHEMBL7770971 0.84 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ACHEKMT2AEPHX1
SCHEMBL19513089 0.81 PRMT1 (0.53) ACHEKMT2AEPHX2PRMT1
SCHEMBL7769455 0.81 ACHE (0.41) ALDH1A1SMN1; SMN2ACHEKMT2AEPHX1
SCHEMBL7771611 0.80 ACHE (0.48) ACHEEPHX1EPHX2
SCHEMBL7770935 0.79 EPHX1 (0.62) ACHEEPHX1EPHX2PRMT1

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