SCHEMBL14404682

SCHEMBL14404682

CC#CCNC(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GLA P06280 1/20 0.38
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ACHE P22303 2/20 0.36
ALOX15 P16050 1/20 0.36
SOAT1 P35610 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL9678319 0.84 GAA (0.42) GAAKMT2AMEN1MGAMSI
SCHEMBL23773059 0.83 ACHE (0.33) ALDH1A1ACHE
SCHEMBL9151982 0.82
SCHEMBL29132933 0.81 GAA (0.41) GAAKMT2AMEN1MGAMSI
SCHEMBL9779629 0.79
SCHEMBL300057 0.77
SCHEMBL8439433 0.76
SCHEMBL7523195 0.76
SCHEMBL17070867 0.75 CA12 (0.31)
SCHEMBL29972719 0.74 ALDH1A1 (0.45) GAAKMT2AMEN1MGAMSI

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
EP-1572612-B1 DIHALO-ALLYLOXY-PHENOL DERIVATIVES HAVING PESTICIDAL ACTIVITY SYNGENTA PARTICIPATIONS AG (CH) 2007-10-31 EP disclosed
CN-1025675-C Composition containing carbamic acid derivatives for controlling insect pests SUMITOMO CHEMICAL COMPANG LIMI (JP) 1994-08-17 CN disclosed