SCHEMBL3678332

SCHEMBL3678332

CCCC(Br)(Br)OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.47
FDPS P14324 12/20 0.43
S1PR2 O95136 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
GGPS1 O95749 5/20 0.34
LPAR3 Q9UBY5 3/20 0.34
LPAR1 Q92633 2/20 0.34
LPAR2 Q9HBW0 2/20 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
SCHEMBL4062621 0.81 SMPD1 (0.41) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL3685377 0.81 CYP3A4 (0.37) SMPD1FDPS
SCHEMBL5908958 0.76 SMPD1 (0.50) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL5964459 0.74 SMPD1 (0.48) SMPD1FDPSGGPS1LPAR3LPAR1
SCHEMBL1923635 0.74 SMPD1 (0.48) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL5908917 0.73 SMPD1 (0.47) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL5908847 0.73 SMPD1 (0.47) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL28934860 0.73 SMPD1 (0.47) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL29132879 0.71 SMPD1 (0.41) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL1923665 0.71 SMPD1 (0.46) SMPD1FDPSS1PR2S1PR4S1PR1

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-2155391-A1 TWO STAGE ACTIVATION OF OLIGOMERISATION CATALYST AND OLIGOMERISATION OF OLEFINIC COMPOUNDS IN THE PRESENCE OF AN OLIGOMERISATION CATALYST SO ACTIVATED Sasol Technology (PTY) Limited (ZA) 2010-02-24 EP disclosed
WO-2008146215-A1 TWO STAGE ACTIVATION OF OLIGOMERISATION CATALYST AND OLIGOMERISATION OF OLEFINIC COMPOUNDS IN THE PRESENCE OF AN OLIGOMERISATION CATALYST SO ACTIVATED SASOL TECHNOLOGY (PTY) LIMITED (ZA) 2008-12-04 WO disclosed