SCHEMBL10859752

SCHEMBL10859752

CCC(=O)Nc1cccc(N2C(=O)CC(C)(CC)C2=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 1/20 0.54
TSHR P16473 1/20 0.54
RAB9A P51151 3/20 0.46
POLB P06746 2/20 0.46
NR4A1 P22736 1/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45
LMNA P02545 3/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 2/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
XBP1 P17861 1/20 0.43
HTT P42858 1/20 0.43
CCR6 P51684 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL10853443 0.88 RAB9A (0.48) ALDH1A1TSHRRAB9APOLBNR4A1
SCHEMBL10853175 0.85 KMT2A (0.55) ALDH1A1RAB9APOLBNR4A1KMT2A
SCHEMBL9824244 0.77 ALDH1A1 (0.56) ALDH1A1KDM4ETSHRKMT2AMEN1
SCHEMBL9823913 0.73 HPN (0.52) ALDH1A1KDM4ETSHRKMT2AMEN1
SCHEMBL10857073 0.71 MEN1 (0.43) ALDH1A1KDM4ETSHRPOLBKMT2A
SCHEMBL10970617 0.70 RAB9A (0.85) ALDH1A1RAB9APOLBNR4A1KMT2A
SCHEMBL11228625 0.70 AR (0.48) ALDH1A1KDM4ETSHRKMT2AMEN1
SCHEMBL10850328 0.69 AR (0.48) ALDH1A1POLBKMT2AMEN1GAA
SCHEMBL10396194 0.68 POLB (0.56) ALDH1A1KDM4ETSHRRAB9APOLB
SCHEMBL28089438 0.68 ITGB3 (0.55) ALDH1A1KDM4ERAB9APOLBNR4A1

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-4595408-A N-m-phenyl succinimide and glutarimide derivatives and their use as herbicides STAUFFER CHEMICAL CO. (US) 1986-06-17 US disclosed