SCHEMBL10737597

SCHEMBL10737597

CCOC(=O)C(C)Oc1ccc(N(C)c2ncnc3cc(Cl)ccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 8/20 0.47
EGFR P00533 6/20 0.47
HDAC1 Q13547 4/20 0.44
HDAC8 Q9BY41 4/20 0.44
HDAC6 Q9UBN7 4/20 0.44
EPHX2 P34913 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.40
HTT P42858 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL10987288 0.82 EPHX2 (0.42) EGFREPHX2L3MBTL1LMNAKMT2A
SCHEMBL11286463 0.82 L3MBTL1 (0.52) CSF1REPHX2L3MBTL1LMNAKMT2A
SCHEMBL11191736 0.82 L3MBTL1 (0.41) EGFREPHX2L3MBTL1LMNAKMT2A
SCHEMBL10684964 0.80 LMNA (0.45) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL11225749 0.78 MAPT (0.48) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL11090798 0.78 KMT2A (0.42) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL10961514 0.78 EPHX2 (0.43) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL11097303 0.77 EPHX2 (0.42) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL10730420 0.77 L3MBTL1 (0.42) EPHX2L3MBTL1LMNAKMT2ATP53
SCHEMBL10734394 0.77 KMT2A (0.42) EPHX2L3MBTL1LMNAKMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4675047-A MONOCOTYLEDON WEES ICI AUSTRALIA LIMITED, 1 NICHOLSON ST., MELBOURNE, VICTORIA, 3000, AUSTRALIA, A CORP. OF AUSTRALIA 1987-06-23 US disclosed
EP-0044163-A2 Quinazolinyloxy(amino)phenoxyalkane carboxylic acid derivatives, process for their synthesis, herbicidal compositions containing them and their use as herbicides ICI AUSTRALIA LIMITED (AU) 1982-01-20 EP disclosed