SCHEMBL5850849

SCHEMBL5850849

S=P(OCl)(Oc1ccccc1Br)Oc1ccccc1Br

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
RAB9A P51151 3/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
KMT2A Q03164 3/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.31
LMNA P02545 2/20 0.30
HPGD P15428 1/20 0.30
GRM4 Q14833 1/20 0.30

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
SCHEMBL5850843 0.79 HTR7 (0.36) HTR7SMN1; SMN2RAB9AMAPTNPC1
SCHEMBL5850487 0.77
SCHEMBL5851944 0.77 MAPK1 (0.36) SMN1; SMN2MAPTKMT2AHTTMEN1
SCHEMBL5851935 0.76 TSHR (0.38) SMN1; SMN2RAB9AMAPTNPC1KMT2A
SCHEMBL8016604 0.76 CA1 (0.52) MAPTKMT2AHTTMEN1KDM4E
SCHEMBL9057707 0.76 LMNA (0.37) HTR7SMN1; SMN2RAB9AMAPTNPC1
SCHEMBL5850422 0.76 LMNA (0.37) HTR7SMN1; SMN2RAB9AMAPTNPC1
SCHEMBL3230150 0.73 LMNA (0.52) SMN1; SMN2RAB9AMAPTKMT2AHTT
SCHEMBL5850355 0.73
SCHEMBL9058388 0.73 INPPL1 (0.37) SMN1; SMN2RAB9AMAPTNPC1KMT2A

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