SCHEMBL11260293

SCHEMBL11260293

NC(=O)c1cc(C(=O)O)c(C(=O)OC(=O)c2cc(C(=O)O)c(C(N)=O)cc2C(=O)O)cc1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
KMT2A Q03164 4/20 0.33
KDM4E B2RXH2 4/20 0.33
MEN1 O00255 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP2D6 P10635 1/20 0.33
CTNNB1 P35222 1/20 0.33
GRM8 O00222 1/20 0.33
GRM6 O15303 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
DRD3 P35462 1/20 0.33
GRM4 Q14833 1/20 0.33
GFER P55789 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MAPT P10636 3/20 0.32
CYP3A4 P08684 3/20 0.32

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
SCHEMBL887647 0.89 ALDH1A1 (0.39) ALDH1A1KMT2AKDM4EMEN1TDP1
Hydrochloric Acid SCHEMBL9081678 0.86 ALDH1A1 (0.38) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL11702468 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL27617170 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL11258908 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL10963459 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL18079069 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL2433986 0.79 ALDH1A1 (0.39) ALDH1A1KMT2AKDM4EMEN1HSD17B10
Acetamide SCHEMBL28942745 0.79 ALOX15 (0.40) ALDH1A1KMT2AKDM4EMEN1TDP1
SCHEMBL28105556 0.79 IDO1 (0.43) ALDH1A1KMT2AKDM4EMEN1TDP1

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-0015083-B1 PYROMELLITIC DIIMIDE COMPLEXES, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE IN IMPROVING THE FEED EFFICIENCY OF RUMINANTS MERCK & CO. INC. (US) 1982-12-29 EP disclosed
US-4320129-A INCREASING FEED EFFICIENCY IN RUMINANT ANIMALS MERCK & CO., INC. (US) 1982-03-16 US disclosed
EP-0015083-A1 Pyromellitic diimide complexes, their preparation, compositions containing them and their use in improving the feed efficiency of ruminants MERCK & CO. INC. (US) 1980-09-03 EP disclosed