SCHEMBL7769845

SCHEMBL7769845

CCCCC(=O)[N]NC(=O)CCCCl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.46
ALDH1A1 P00352 7/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TP53 P04637 1/20 0.38
HSP90AA1 P07900 1/20 0.37
KDM4E B2RXH2 3/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 3/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALOX12 P18054 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL7773606 0.91 FAAH (0.43) FAAHALDH1A1MEN1KMT2AHSP90AA1
SCHEMBL7769447 0.85 FAAH (0.42) FAAHALDH1A1MEN1KMT2ATP53
SCHEMBL7765838 0.85 FAAH (0.41) FAAHALDH1A1MEN1KMT2AHSP90AA1
SCHEMBL7769860 0.82 ALDH1A1 (0.40) FAAHALDH1A1MEN1KMT2AHSP90AA1
SCHEMBL7771382 0.81 ALDH1A1 (0.42) FAAHALDH1A1MEN1KMT2AHSP90AA1
SCHEMBL7770041 0.79 CES1 (0.39) FAAHALDH1A1MEN1KMT2ATP53
SCHEMBL7766040 0.78 CES1 (0.38) FAAHALDH1A1MEN1KMT2ATP53
SCHEMBL7771427 0.78 CES1 (0.38) FAAHALDH1A1MEN1KMT2ATP53
SCHEMBL7771569 0.77 KDM4E (0.41) FAAHALDH1A1MEN1KMT2AKDM4E
SCHEMBL7769341 0.75 ALDH1A1 (0.46) FAAHALDH1A1MEN1KMT2ATP53

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