SCHEMBL11550849

SCHEMBL11550849

O=C(CCl)NC(NC(=O)c1cccc(Cl)c1)C(Cl)(Cl)Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
MAPT P10636 7/20 0.61
MEN1 O00255 7/20 0.61
KMT2A Q03164 7/20 0.61
LMNA P02545 6/20 0.61
HTT P42858 5/20 0.61
NPSR1 Q6W5P4 5/20 0.61
ALOX12 P18054 3/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.59
HPGD P15428 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 2/20 0.48
TP53 P04637 1/20 0.47
NPY1R P25929 1/20 0.47
MYC P01106 1/20 0.46

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
SCHEMBL392370 0.84 LMNA (0.55) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL12156713 0.78 MEN1 (0.61) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9106376 0.75 KMT2A (0.70) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL12136817 0.73 MEN1 (0.81) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL5448808 0.71 HPGD (0.70) MEN1KMT2ALMNANPSR1CYP2C19
SCHEMBL11551155 0.71 ALDH1A1 (0.58) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL11552111 0.71 MEN1 (0.62) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL8737626 0.70 HPGD (0.72) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL18162818 0.70 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL13753580 0.70 HPGD (0.72) ALDH1A1MAPTMEN1KMT2ALMNA

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-4146646-A BIS-AMIDE FUNGICIDAL COMPOUNDS FISONS LIMITED (GB) 1979-03-27 US disclosed