SCHEMBL7769453

SCHEMBL7769453

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

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.40
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EPHX2 P34913 2/20 0.36
EPHX1 P07099 1/20 0.36
HTT P42858 1/20 0.35
PRMT1 Q99873 1/20 0.34

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 0.98 ALDH1A1 (0.41) ACHEKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7770879 0.98 ALDH1A1 (0.41) ACHEKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7771589 0.94 ACHE (0.41) ACHEALDH1A1SMN1; SMN2EPHX1HTT
SCHEMBL7769356 0.86 ACHE (0.35) ACHEHTT
SCHEMBL7769455 0.83 ACHE (0.41) ACHEKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL19513089 0.83 PRMT1 (0.53) ACHEKMT2AEPHX2HTTPRMT1
SCHEMBL7770971 0.81 ALDH1A1 (0.42) ACHEKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7771611 0.81 ACHE (0.48) ACHEEPHX2EPHX1
SCHEMBL7770881 0.81 ALDH1A1 (0.42) ACHEKMT2AALDH1A1SMN1; SMN2EPHX2
SCHEMBL7769387 0.79 EPHX1 (0.59) ACHEKMT2AEPHX1PRMT1

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