SCHEMBL5852154

SCHEMBL5852154

O=P(OCl)(OCCC(Br)Br)OCCC(Br)Br

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 2/20 0.34
TSHR P16473 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
SCHEMBL814577 0.85 CYP3A4 (0.46) ALDH1A1CYP3A4TSHR
SCHEMBL29062255 0.77 ALDH1A1 (0.38) ALDH1A1CYP3A4TSHR
SCHEMBL5852152 0.76
SCHEMBL10882705 0.71 CYP3A4 (0.48) ALDH1A1CYP3A4TSHR
SCHEMBL7085274 0.71 LPAR3 (0.41)
SCHEMBL10343988 0.71 BTN3A1 (0.32) TSHR
SCHEMBL1441945 0.71 ALDH1A1 (0.46) ALDH1A1CYP3A4TSHR
SCHEMBL5850544 0.70 ALDH1A1 (0.74) ALDH1A1CYP3A4TSHR
SCHEMBL5851894 0.70 CYP3A4 (0.41) ALDH1A1CYP3A4TSHR
SCHEMBL178129 0.70 CYP3A4 (0.73) CYP3A4TSHR

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