SCHEMBL7635830

SCHEMBL7635830

[CH2]COC[C](OOC(=O)c1ccccc1-c1ccccc1)OOC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 5/20 0.43
SCN2A Q99250 5/20 0.43
SCN3A Q9NY46 5/20 0.43
BCAT2 O15382 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRNB2 P17787 5/20 0.39
CHRNB4 P30926 5/20 0.39
CHRNA3 P32297 5/20 0.39
CHRNA4 P43681 5/20 0.39
SLC6A3 Q01959 3/20 0.39
SLC6A4 P31645 2/20 0.39
ADORA3 P0DMS8 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
HNF4A P41235 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
SCHEMBL7633664 0.93 SCN1A (0.43) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL7633509 0.85 BCAT2 (0.47) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL7631143 0.82 SCN1A (0.45) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL9790236 0.81 BCAT2 (0.61) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL7635606 0.80 BCAT2 (0.49) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL7627538 0.80 CTSD (0.45) KMT2ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL7632835 0.80 SCN1A (0.44) SCN1ASCN2ASCN3ABCAT2MEN1
SCHEMBL7624034 0.79 KDM4E (0.49) SMN1; SMN2ALDH1A1
SCHEMBL7633979 0.79 MEN1 (0.43) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7631061 0.79 SCN1A (0.43) SCN1ASCN2ASCN3ABCAT2MEN1

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed