SCHEMBL11259017

SCHEMBL11259017

CCCC(=O)n1c(=O)c2cc3c(=O)n(C(=O)CCC)c(=O)c3cc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ELANE P08246 3/20 0.42
GAA P10253 2/20 0.41
CES1 P23141 2/20 0.39
NPSR1 Q6W5P4 2/20 0.36
POLB P06746 2/20 0.36
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SRC P12931 1/20 0.35
CES2 O00748 1/20 0.35
HTR7 P34969 3/20 0.34
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 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
SCHEMBL31566138 0.67 LMNA (0.47) ALDH1A1GAANPSR1POLBHPGD
SCHEMBL18485449 0.67 CES1 (0.47) ALDH1A1ELANECES1NPSR1POLB
SCHEMBL24439270 0.65 ALDH1A1 (0.51) ALDH1A1GAANPSR1POLBSRC
SCHEMBL24439038 0.65 ALDH1A1 (0.47) ALDH1A1GAANPSR1POLBHSD17B10
SCHEMBL11267711 0.64 ALDH1A1 (0.58) ALDH1A1GAANPSR1POLBTSHR
SCHEMBL11153369 0.63 ALDH1A1 (0.37) ALDH1A1ELANEGAANPSR1POLB
SCHEMBL8178094 0.62 CES1 (0.43) ELANECES1POLBTSHRCES2
SCHEMBL8777494 0.62 TDP1 (0.68) ALDH1A1GAANPSR1POLBTDP1
SCHEMBL5058935 0.61 CES1 (0.68) ALDH1A1ELANEGAACES1HPGD
SCHEMBL6627600 0.61 CES1 (0.39) ALDH1A1ELANECES1HPGDTSHR

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-0010441-B1 THE USE OF SYMMETRICALLY SUBSTITUTED PYROMELLITIC DIIMIDES AS RUMINANT FEED ADDITIVES. COMPOSITIONS CONTAINING THESE FEED ADDITIVES MERCK & CO. INC. (US) 1982-04-21 EP disclosed
US-4212880-A INCREASE FEED EFFICIENCY MERCK & CO., INC. (US) 1980-07-15 US disclosed
EP-0010441-A1 The use of symmetrically substituted pyromellitic diimides as ruminant feed additives. Compositions containing these feed additives MERCK & CO. INC. (US) 1980-04-30 EP disclosed