SCHEMBL8439476

SCHEMBL8439476

CC(C)(c1cc(Br)c(OC(Br)CCBr)c(Br)c1)c1cc(Br)c(OC(Br)CCBr)c(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
ALOX15 P16050 2/20 0.40
ALOX12 P18054 2/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
RECQL P46063 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CHEK1 O14757 1/20 0.35
DAPK3 O43293 1/20 0.35
RET P07949 1/20 0.35
PDGFRB P09619 1/20 0.35
PIM1 P11309 1/20 0.35
PDGFRA P16234 1/20 0.35
KDR P35968 1/20 0.35
MAPK8 P45983 1/20 0.35
RPS6KA3 P51812 1/20 0.35

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
SCHEMBL10808434 0.87 ALDH1A1 (0.50) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL11502474 0.86 ALDH1A1 (0.61) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL8858957 0.77 ALDH1A1 (0.53) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL7858103 0.73
SCHEMBL17076583 0.73 ALDH1A1 (0.66) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL12670386 0.73 ALDH1A1 (0.47) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL12670389 0.72 ALDH1A1 (0.46) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL25898 0.72 ALDH1A1 (0.50) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL8858958 0.72 ALDH1A1 (0.60) ALDH1A1ALOX15ALOX12CYP3A4HPGD
SCHEMBL8439473 0.71 ALDH1A1 (0.59) ALDH1A1ALOX15ALOX12CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11199717-A None JP disclosed
JP-8113547-A None JP disclosed
JP-H11199717-A ANTIMONY-FREE FLAME-RETARDANT POLYOLEFIN COMPOSITION MARUBISHI OIL CHEM CO LTD 1999-07-27 JP disclosed
JP-H08113547-A 2,2-BIS(3,5-DIBROMO-4-DIBROMOPROPOXYPHENYL)PROPANE HAVING LARGE PARTICLE DIAMETER AND ITS PRODUCTION TOSOH CORP 1996-05-07 JP disclosed
EP-0115341-B1 GRANULAR ORGANOHALIDE FLAME RETARDANT ADDITIVE AND METHODS OF PREPARING THE SAME SEKISUI KASEIHIN KOGYO KABUSHIKI KAISHA (JP) 1987-09-30 EP disclosed
US-4530880-A Thermoplastic resin binder SEKISUI KASEIHIN KOGYO KABUSHIKI KAISHA (JP) 1985-07-23 US disclosed
EP-0115341-A2 Granular organohalide flame retardant additive and methods of preparing the same SEKISUI KASEIHIN KOGYO KABUSHIKI KAISHA (JP) 1984-08-08 EP disclosed