SCHEMBL5850877

SCHEMBL5850877

CCCCC(C)OP(=O)(O)Cl

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.47
SMPD1 P17405 3/20 0.44
LAP3 P28838 2/20 0.38
METAP1 P53582 1/20 0.38
S1PR2 O95136 5/20 0.38
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 5/20 0.38
S1PR4 O95977 4/20 0.38
FAAH O00519 1/20 0.37
CYP3A4 P08684 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL5850876 0.83 FDPS (0.40) FDPSSMPD1FAAHCYP3A4L3MBTL1
SCHEMBL3823543 0.83 FDPS (0.50) FDPSSMPD1LAP3METAP1S1PR2
SCHEMBL3010735 0.83 SMPD1 (0.57) FDPSSMPD1LAP3METAP1S1PR2
SCHEMBL8555956 0.79
SCHEMBL3814007 0.79 CYP3A4 (0.45) FDPSSMPD1CYP3A4L3MBTL1
SCHEMBL3813612 0.78 SMPD1 (0.55) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL3822629 0.78 CYP3A4 (0.41) FDPSSMPD1FAAHCYP3A4L3MBTL1
SCHEMBL4947189 0.78 SMPD1 (0.66) FDPSSMPD1LAP3S1PR2S1PR1
SCHEMBL29790872 0.77 SMPD1 (0.46) FDPSSMPD1LAP3METAP1S1PR2
SCHEMBL27809466 0.77 FDPS (0.44) FDPSSMPD1LAP3METAP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153901-B2 Low viscosity flame retardants are the reaction product of a mixed ester of tetrabromophthalic acid with diethylene glycol and propylene glycol with an acid anhydride, organic phosphate, or organic chlorophosphate; minimizing visible scorching of the flexible polyurethane foam during its production ALBEMARLE CORPORATION (US) 2006-12-26 US disclosed
EP-1685176-A2 FLAME RETARDANT, ADDITIVE COMPOSITIONS, AND FLAME RETARDANT POLYURETHANES ALBEMARLE CORPORATION (US) 2006-08-02 EP disclosed
WO-2005052018-A2 FLAME RETARDANT, ADDITIVE COMPOSITIONS, AND FLAME RETARDANT POLYURETHANES ALBEMARLE CORPORATION (US) 2005-06-09 WO disclosed
US-20050113495-A1 Flame retardant, additive compositions, and flame retardant polyurethanes ALBEMARLE CORPORATION 2005-05-26 US disclosed