SCHEMBL7769247

SCHEMBL7769247

CCC(=O)CCCC([NH])=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.33
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
ALDH1A1 P00352 2/20 0.32
FFAR3 O14843 1/20 0.32
IAPP P10997 2/20 0.31
HAO1 Q9UJM8 1/20 0.31
TSHR P16473 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.30

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
SCHEMBL1771453 0.86 TDP1 (0.60) TDP1MAPTKMT2ALMNACES2
SCHEMBL7765768 0.83
SCHEMBL7769866 0.82 MAPT (0.43) MAPTKMT2ACES2CES1ALDH1A1
SCHEMBL23735973 0.80 TDP1 (0.53) TDP1MAPTKMT2ALMNACES2
SCHEMBL12673292 0.80 TDP1 (0.60) TDP1MAPTKMT2ACES2CES1
SCHEMBL1707003 0.77 TDP1 (0.56) TDP1MAPTKMT2ACES2CES1
SCHEMBL12299385 0.77 TDP1 (0.56) TDP1MAPTKMT2ACES2CES1
SCHEMBL17776278 0.77 TDP1 (0.56) TDP1MAPTKMT2ACES2CES1
SCHEMBL13232045 0.77 TDP1 (0.56) TDP1MAPTKMT2ACES2CES1
SCHEMBL11000950 0.77 TDP1 (0.56) TDP1MAPTKMT2ACES2CES1

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