SCHEMBL456427

SCHEMBL456427

CCCCCCCCCCN1CCCC1(O)C(=O)O.[Cu]

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.40
S1PR3 Q99500 2/20 0.40
S1PR5 Q9H228 2/20 0.40
S1PR4 O95977 1/20 0.39
BCHE P06276 5/20 0.35
OPRM1 P35372 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL9555188 0.98 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL454182 0.98 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL10527688 0.98 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL28772993 0.98 S1PR1 (0.41) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL9357045 0.97 S1PR1 (0.39) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL9357038 0.97 S1PR1 (0.39) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL8893018 0.92 S1PR1 (0.36) S1PR1S1PR3S1PR5S1PR4L3MBTL1
SCHEMBL8893030 0.92 S1PR1 (0.36) S1PR1S1PR3S1PR5S1PR4L3MBTL1
Palmitamide SCHEMBL1072214 0.90 MEN1 (0.40) S1PR1S1PR3S1PR5S1PR4BCHE
SCHEMBL949468 0.87 L3MBTL1 (0.36) S1PR1S1PR3S1PR5S1PR4L3MBTL1

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-2616169-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS Natrix Separations Inc. (CA) 2013-07-24 EP claimed
WO-2012037101-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS NATRIX SEPARATIONS INC. (CA) 2012-03-22 WO claimed
US-20120064601-A1 Chromatography Membranes for the Purification of Chiral Compounds NATRIX SEPARATIONS INC. (CA) 2012-03-15 US claimed
EP-2616169-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS Natrix Separations Inc. (CA) 2013-07-24 EP disclosed
WO-2012037101-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS NATRIX SEPARATIONS INC. (CA) 2012-03-22 WO disclosed
US-20120064601-A1 Chromatography Membranes for the Purification of Chiral Compounds NATRIX SEPARATIONS INC. (CA) 2012-03-15 US disclosed