SCHEMBL4414178

SCHEMBL4414178

O=P(O)(O)OCCCCC(Br)(Br)Br

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.52
LPAR2 Q9HBW0 6/20 0.52
LPAR1 Q92633 4/20 0.52
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
CSNK2A3 Q8NEV1 1/20 0.39
SMPD1 P17405 3/20 0.33
LPAR5 Q9H1C0 1/20 0.33
S1PR4 O95977 2/20 0.32
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
S1PR5 Q9H228 2/20 0.32

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
SCHEMBL11585600 0.93 LPAR3 (0.48) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL2414727 0.84 LPAR3 (0.41) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL5085588 0.82 CYP3A4 (0.46) LPAR3LPAR2LPAR1
SCHEMBL1574125 0.81 LPAR3 (0.71) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL5852292 0.80 LPAR3 (0.34) LPAR3LPAR2LPAR1
SCHEMBL5964242 0.78 LPAR3 (0.52) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL2156001 0.78 LPAR3 (0.52) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL9233772 0.78 LPAR3 (0.76) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL6851142 0.78 LPAR3 (0.76) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL6033633 0.78 LPAR3 (0.76) LPAR3LPAR2LPAR1CSNK2A2CSNK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113088048-A Light-weight corrosion-resistant flange and preparation method thereof 无锡市星达石化配件有限公司 2021-07-09 CN claimed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US claimed
CN-113088048-A Light-weight corrosion-resistant flange and preparation method thereof 无锡市星达石化配件有限公司 2021-07-09 CN disclosed
CN-113088048-A Light-weight corrosion-resistant flange and preparation method thereof 无锡市星达石化配件有限公司 2021-07-09 CN disclosed
EP-1513893-B1 FLAME RETARDANT POLYMER COMPOSITIONS CONTAINING HYDROXYLAMINE ESTERS CIBA HOLDING INC (CH) 2009-01-07 EP disclosed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US disclosed
US-20050203222-A1 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. 2005-09-15 US disclosed
EP-1513893-A2 FLAME RETARDANT POLYMER COMPOSITIONS CONTAINING HYDROXYLAMINE ESTERS Ciba SC Holding AG (CH) 2005-03-16 EP disclosed
WO-2003087211-A2 FLAME RETARDANT POLYMER COMPOSITIONS CONTAINING HYDROXYLAMINE ESTERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-10-23 WO disclosed