SCHEMBL9399985

SCHEMBL9399985

CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCNC(=O)OCCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCCC(=O)O.CCCCCCCCCCOC(=O)NCCCCCCCCCCC(=O)O

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.76
ACHE P22303 13/20 0.64
DGKA P23743 1/20 0.56
PLA2G2A P14555 1/20 0.54
PAM P19021 2/20 0.51

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
SCHEMBL9576939 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9576877 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9363110 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9577040 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9367499 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9362773 0.94 ACHE (0.72) EPHX2ACHEDGKA
SCHEMBL9190902 0.94 EPHX2 (0.84) EPHX2ACHEPLA2G2A
SCHEMBL8973356 0.94 EPHX2 (0.84) EPHX2ACHEPLA2G2A
SCHEMBL8920145 0.94 EPHX2 (0.84) EPHX2ACHEPLA2G2A
SCHEMBL8973552 0.94 EPHX2 (0.84) EPHX2ACHEPLA2G2A

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-5286475-A Containing an carbamate foaming agent L'OREAL (FR) 1994-02-15 US claimed