SCHEMBL13934751

SCHEMBL13934751

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)C(=O)NCC[Si](OCC)(OCC)OCC

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.38
EPHX2 P34913 2/20 0.36
DNM1 Q05193 2/20 0.36
MGLL Q99685 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 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
SCHEMBL29837984 0.93 EPHX1 (0.40) EPHX1EPHX2DNM1
SCHEMBL1203085 0.93 EPHX1 (0.40) EPHX1EPHX2DNM1
SCHEMBL13934745 0.93 EPHX1 (0.40) EPHX1EPHX2DNM1
SCHEMBL23373135 0.91 EPHX1 (0.42) EPHX1EPHX2DNM1
SCHEMBL4534944 0.91 EPHX1 (0.42) EPHX1EPHX2DNM1
SCHEMBL14672658 0.91 EPHX1 (0.42) EPHX1EPHX2DNM1
SCHEMBL4407700 0.84 EPHX1 (0.36) EPHX1EPHX2CA12CA1CA2
SCHEMBL2563904 0.83 CA12 (0.32) EPHX1CA12CA1CA2CA9
SCHEMBL25768096 0.82 EPHX1 (0.34) EPHX1EPHX2CA12CA1CA2
SCHEMBL2616684 0.81 ACHE (0.33) EPHX1DNM1CA12CA1CA2

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-20090042021-A1 Metal-Coated Lipid Bilayer Vesicles and Process for Producing Same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2009-02-12 US disclosed