SCHEMBL11267012

SCHEMBL11267012

CCCOC(=O)C(C)Oc1ccc(N(C)c2cnc3cc(Cl)ccc3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CYP1A2 P05177 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
NFKB1 P19838 1/20 0.46
HIF1A Q16665 1/20 0.46
GMNN O75496 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
APEX1 P27695 1/20 0.46
PMP22 Q01453 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RXRA P19793 2/20 0.38
DHODH Q02127 1/20 0.37

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
SCHEMBL11225749 0.92 MAPT (0.48) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11270736 0.88 MAPT (0.49) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11267584 0.86 CYP1A2 (0.51) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11264919 0.86 CYP1A2 (0.51) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL10973729 0.84 MAPT (0.65) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11273121 0.84 CYP1A2 (0.65) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11095436 0.84 TDP1 (0.41) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11262348 0.83 ALDH1A1 (0.42) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL11263881 0.82 L3MBTL1 (0.46) MAPTCYP1A2LMNATP53CYP3A4
SCHEMBL10680242 0.81 L3MBTL1 (0.51) MAPTCYP1A2LMNATP53CYP3A4

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