SCHEMBL10397608

SCHEMBL10397608

CN(C(=O)C(=O)NCCCCNC1CC(C)(C)NC(C)(C)C1)N1C(=O)c2c(Br)c(Br)c(Br)c(Br)c2C1=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
SLC2A1 P11166 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
GLA P06280 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL10396686 0.71 ALDH1A1 (0.39) GAAALDH1A1KDM4ETP53GLA
SCHEMBL8432690 0.67 SLC2A1 (0.50) GAASLC2A1ALDH1A1KDM4ENPSR1
SCHEMBL11366356 0.66 EPHX2 (0.43) GAASLC2A1POLB
SCHEMBL9461938 0.66 SLC2A1 (0.52) GAASLC2A1ALDH1A1KDM4ENPSR1
SCHEMBL10780893 0.66 SLC2A1 (0.52) GAASLC2A1ALDH1A1KDM4ENPSR1
SCHEMBL38851 0.66 SLC2A1 (0.52) GAASLC2A1ALDH1A1KDM4ENPSR1
SCHEMBL8432492 0.66 SLC2A1 (0.52) GAASLC2A1ALDH1A1KDM4ENPSR1
SCHEMBL10396993 0.65 GAA (0.43) GAAALDH1A1KDM4ETP53GLA
SCHEMBL10444980 0.64 GAA (0.46) GAASLC2A1KDM4EPOLBMEN1
SCHEMBL9375619 0.64 GAA (0.42) GAASLC2A1ALDH1A1KDM4EGLA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4978699-A Reaction product of hindered amine with primary amine or reactive hydrazide group and halogenated cyclic anhydride; for extrusion with polymers ATOCHEM NORTH AMERICA, INC. (US) 1990-12-18 US disclosed