SCHEMBL11269751

SCHEMBL11269751

C=CCOC(=O)Nc1cccc(OC(=O)N(C)c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 1/20 0.41
AGPAT2 O15120 1/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 3/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 1/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
CYP3A4 P08684 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38

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
SCHEMBL11256135 0.90 MEN1 (0.46) GAAKMT2AALDH1A1HPGDMAPT
SCHEMBL11273076 0.89 GAA (0.41) GAAKMT2AALDH1A1HPGDAGPAT2
SCHEMBL11252831 0.88 MEN1 (0.44) GAAKMT2AALDH1A1HPGDAGPAT2
SCHEMBL11252463 0.87 CYP3A4 (0.45) GAAKMT2AALDH1A1AGPAT2MAPT
SCHEMBL11281340 0.87 BCHE (0.51) GAAKMT2AALDH1A1MAPTMEN1
SCHEMBL11254034 0.86 MAPK1 (0.49) GAAKMT2AALDH1A1AGPAT2MAPT
SCHEMBL11430834 0.85 ALDH1A1 (0.52) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL10939890 0.85 LMNA (0.48) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL11268798 0.85 GAA (0.45) GAAKMT2AALDH1A1AGPAT2MAPT
SCHEMBL11256048 0.83 TP53 (0.42) GAAKMT2AALDH1A1MAPTMEN1

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-4317674-A Diurethanes, process for making the same and selective herbicide composition containing same SCHERING AG (DE) 1982-03-02 US claimed