SCHEMBL6678985

SCHEMBL6678985

O=P(O)(O)OCC(Cl)CCl.O=P(O)(OCC(Br)CBr)OCC(Br)CBr

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
ALDH1A1 P00352 1/20 0.32
PGD P52209 2/20 0.31
MPI P34949 1/20 0.31

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
SCHEMBL28213088 0.95 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2793625 0.82 ALDH1A1 (0.38) ALDH1A1
SCHEMBL2796122 0.82 ALDH1A1 (0.38) ALDH1A1
SCHEMBL481474 0.81 ALDH1A1 (0.36) PGK1PGK2ALDH1A1
SCHEMBL2239094 0.81 PGK1 (0.45) PGK1PGK2ALDH1A1PGDMPI
SCHEMBL5852227 0.81 TSHR (0.36) PGK1PGK2
SCHEMBL3425550 0.81 PGK1 (0.45) PGK1PGK2PGDMPI
Calcium SCHEMBL11677062 0.79 PGK1 (0.43) PGK1PGK2PGDMPI
Ammonia Solution, Strong SCHEMBL11700135 0.79 PGK1 (0.43) PGK1PGK2ALDH1A1PGDMPI
Ammonia Solution, Strong SCHEMBL11595930 0.79 ALDH1A1 (0.35) PGK1PGK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1420047-A1 Flame retardant resin composition DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-05-19 EP disclosed
US-6344508-B1 Reclaimed pet resin composition, molded article thereof, and flame-retardant resin composition and molded article thereof DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-05 US disclosed
EP-1050559-A1 RECLAIMED PET RESIN COMPOSITION, MOLDED ARTICLE THEREOF, AND FLAME-RETARDANT RESIN COMPOSITION AND MOLDED ARTICLE THEREOF DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2000-11-08 EP disclosed