SCHEMBL7769455

SCHEMBL7769455

NC(=O)CCCCNC(=O)OCCl

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 1/20 0.38
EPHX1 P07099 1/20 0.37
EPHX2 P34913 2/20 0.37
HTT P42858 1/20 0.36
PRMT1 Q99873 1/20 0.35

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
SCHEMBL7770881 0.98 ALDH1A1 (0.42) ACHEMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL7770971 0.98 ALDH1A1 (0.42) ACHEMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL7771590 0.94 ACHE (0.42) ACHEMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL7769360 0.88 ACHE (0.35) ACHEMAOAMAOBHTT
SCHEMBL19513089 0.85 PRMT1 (0.53) ACHEKMT2AEPHX2HTTPRMT1
SCHEMBL7769453 0.83 ACHE (0.40) ACHEALDH1A1SMN1; SMN2KMT2AEPHX1
SCHEMBL7770969 0.81 ALDH1A1 (0.41) ACHEALDH1A1SMN1; SMN2KMT2AEPHX1
SCHEMBL7770879 0.81 ALDH1A1 (0.41) ACHEALDH1A1SMN1; SMN2KMT2AEPHX1
SCHEMBL7771614 0.81 ACHE (0.50) ACHEMAOAMAOBEPHX1EPHX2
SCHEMBL15550570 0.78 HTT (0.56) ACHEKMT2AEPHX2HTTPRMT1

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