SCHEMBL11269831

SCHEMBL11269831

CCOC(=O)C(C)Oc1ccc(N(C)c2nc3cc(Cl)c(Cl)cc3nc2Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 1/20 0.41
EPHX2 P34913 2/20 0.40
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TUBB4A P04350 3/20 0.36
TUBB P07437 3/20 0.36
TUBA3C P0DPH7 3/20 0.36
TUBA1B P68363 3/20 0.36
TUBA4A P68366 3/20 0.36
TUBB4B P68371 3/20 0.36
TUBB3 Q13509 3/20 0.36
TUBB2A Q13885 3/20 0.36
TUBB8 Q3ZCM7 3/20 0.36
TUBA3E Q6PEY2 3/20 0.36

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
SCHEMBL11264726 0.90 L3MBTL1 (0.47) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10916825 0.85 L3MBTL1 (0.46) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL11263881 0.83 L3MBTL1 (0.46) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10980553 0.80 KMT2A (0.44) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10985791 0.78 LMNA (0.46) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10987288 0.78 EPHX2 (0.42) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10734394 0.76 KMT2A (0.42) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10981011 0.76 KMT2A (0.42) GAATDP1KMT2AL3MBTL1LMNA
SCHEMBL10737597 0.76 CSF1R (0.47) KMT2AL3MBTL1LMNAEPHX2EGFR
SCHEMBL10977364 0.75 L3MBTL1 (0.45) GAATDP1KMT2AL3MBTL1LMNA

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-4358307-A PREFERENTIAL CONTROLLING OF MONOCOTYLEDONS IN CROPS ICI AUSTRALIA LIMITED (AU) 1982-11-09 US disclosed
EP-0026622-A2 Quinoxalinylaminophenoxyalkane carboxylic acid derivatives, their preparation, their use as herbicides and intermediates ICI AUSTRALIA LIMITED (AU) 1981-04-08 EP disclosed