SCHEMBL3817432

SCHEMBL3817432

[CH2]CCCC(CC)OCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.50
LPAR1 Q92633 6/20 0.39
LPAR3 Q9UBY5 6/20 0.39
LPAR2 Q9HBW0 3/20 0.39
CNR1 P21554 4/20 0.38
CNR2 P34972 3/20 0.38
ALDH1A1 P00352 1/20 0.38
LPAR6 P43657 2/20 0.36
LPAR4 Q99677 2/20 0.36
LPAR5 Q9H1C0 2/20 0.36
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34

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
SCHEMBL8778602 0.94 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL27759847 0.94 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL10498368 0.92 DNM1 (0.46) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL9098299 0.90 DNM1 (0.52) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL23017083 0.88 DNM1 (0.57) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL28360383 0.88 DNM1 (0.57) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL7156427 0.88 DNM1 (0.57) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL25258976 0.88 DNM1 (0.57) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL13292250 0.88 DNM1 (0.57) DNM1LPAR1LPAR3LPAR2CNR1
SCHEMBL9118432 0.86 DNM1 (0.38) DNM1LPAR1LPAR3LPAR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089373-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-08-19 EP disclosed
EP-1957073-A2 MEDICINAL DRUG OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-08-20 EP disclosed
WO-2008044667-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-04-17 WO disclosed
WO-2007066784-A2 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 WO disclosed
EP-1773797-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-18 EP disclosed
WO-2006014012-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-09 WO disclosed