SCHEMBL7769860

SCHEMBL7769860

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HSP90AA1 P07900 1/20 0.37
KDM4E B2RXH2 3/20 0.36
FAAH O00519 2/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 4/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.34
DNM1 Q05193 1/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.33

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
SCHEMBL7771382 0.95 ALDH1A1 (0.42) ALDH1A1HSP90AA1KDM4EFAAHMEN1
SCHEMBL7773562 0.91 ALDH1A1 (0.41) ALDH1A1HSP90AA1KDM4EFAAHMEN1
SCHEMBL7765801 0.86 ALDH1A1 (0.43) ALDH1A1HSP90AA1KDM4EFAAHMEN1
SCHEMBL7771427 0.85 CES1 (0.38) ALDH1A1HSP90AA1KDM4EFAAHCES2
SCHEMBL7770619 0.85 KDM4E (0.38) ALDH1A1HSP90AA1KDM4EFAAHMEN1
SCHEMBL7769845 0.82 FAAH (0.46) ALDH1A1HSP90AA1KDM4EFAAHCES2
SCHEMBL7765939 0.80 ALDH1A1 (0.41) ALDH1A1HSP90AA1KDM4EFAAHMEN1
SCHEMBL7770041 0.79 CES1 (0.39) ALDH1A1HSP90AA1KDM4EFAAHCES2
SCHEMBL7769447 0.78 FAAH (0.42) ALDH1A1HSP90AA1KDM4EFAAHCES2
SCHEMBL7766040 0.78 CES1 (0.38) ALDH1A1HSP90AA1KDM4EFAAHCES2

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