SCHEMBL1477902

SCHEMBL1477902

CCCCOC(=O)C(CC)CCCC.CCCCOC(=O)C(CC)CCCC

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.68
CA1 P00915 4/20 0.68
MAPK1 P28482 1/20 0.57
ALDH1A1 P00352 1/20 0.50
ATM Q13315 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
XBP1 P17861 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 3/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
NAAA Q02083 1/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40

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
SCHEMBL120636 1.00 CA2 (0.68) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL304869 1.00 CA2 (0.68) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL11099379 0.98 CA2 (0.66) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL30558902 0.98 CA2 (0.66) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL28078701 0.98 CA2 (0.66) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL27658614 0.98 CA2 (0.66) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL1942106 0.96 CA2 (0.68) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL29528988 0.96 CA2 (0.68) CA2CA1MAPK1ALDH1A1ATM
SCHEMBL4409958 0.94 CA2 (0.66) CA2CA1MAPK1TSHRNAAA
SCHEMBL9736174 0.94 CA2 (0.66) CA2CA1MAPK1TSHRNAAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7914695-B2 Magnet using binding agent and method of manufacturing the same HITACHI, LTD. (JP) 2011-03-29 US disclosed
US-20080317620-A1 Rare earth element magnet HITACHI, LTD. 2008-12-25 US disclosed
EP-1835514-A2 Magnet using binding agent and method of manufacturing the same Hitachi, Ltd. (JP) 2007-09-19 EP disclosed
US-20070209737-A1 Magnet Using Binding Agent and Method of Manufacturing the Same HITACHI, LTD. (JP) 2007-09-13 US disclosed
US-4478975-A FLUOROPOLYMER AND POLYURETHANES OR POLYETHERURETHANES ATOCHEM (FR) 1984-10-23 US disclosed