SCHEMBL6653698

SCHEMBL6653698

C=C(C)CCCC.C=CC(C)CCC

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.30
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6651983 0.87 MEN1 (0.33) CES1MEN1CYP3A4KMT2A
SCHEMBL29883 0.84
SCHEMBL3389593 0.84
SCHEMBL19006673 0.80
SCHEMBL14481257 0.79
SCHEMBL28157372 0.78
SCHEMBL21838330 0.78
SCHEMBL72849 0.78
SCHEMBL18074823 0.78
SCHEMBL2120363 0.77

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-1423398-A2 NOVEL PHOSPHITE COMPOUNDS AND NOVEL PHOSPHITE METAL COMPLEXES Oxeno Olefinchemie GmbH (DE) 2004-06-02 EP disclosed
WO-2003016321-A2 NOVEL PHOSPHITE COMPOUNDS AND NOVEL PHOSPHITE METAL COMPLEXES OXENO OLEFINCHEMIE GMBH (DE) 2003-02-27 WO disclosed