SCHEMBL8859515

SCHEMBL8859515

O=C1C(c2ccccc2)=C(c2cccc(Br)c2Br)C(=O)N1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ PTGS2 P35354 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ P2RX7 Q99572 1/20 0.34
▸ FGFR1 P11362 3/20 0.33
▸ FGFR2 P21802 3/20 0.33
▸ FGFR4 P22455 3/20 0.33
▸ FGFR3 P22607 3/20 0.33
▸ MITF O75030 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ CYP1B1 Q16678 2/20 0.33
▸ HSP90AA1 P07900 3/20 0.33
▸ HSP90AB1 P08238 3/20 0.33
▸ SRC P12931 2/20 0.33
▸ CDC25B P30305 2/20 0.33

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
SCHEMBL6046983 0.81 PIM1 (0.33) ALDH1A1CYP1B1RAB9A
SCHEMBL6046987 0.73 NR1H2 (0.37) ALDH1A1MAPK1PTGS2MAPTLMNA
SCHEMBL1627501 0.72 ALDH1A1 (0.68) ALDH1A1MAPK1MAPTTDP1RAB9A
SCHEMBL29356458 0.72 ALDH1A1 (0.68) ALDH1A1MAPK1MAPTTDP1RAB9A
SCHEMBL27830861 0.70 ALDH1A1 (0.65) ALDH1A1MAPK1MAPTTDP1RAB9A
Water SCHEMBL2804005 0.70 ALDH1A1 (0.65) ALDH1A1MAPK1MAPTTDP1RAB9A
SCHEMBL331537 0.70 ALDH1A1 (0.39) ALDH1A1MAPK1MAPTGAAP2RX7
Bicarbonate SCHEMBL11404243 0.70 ALDH1A1 (0.58) ALDH1A1MAPK1MAPTLMNAHTT
SCHEMBL7519292 0.69 ALDH1A1 (0.62) ALDH1A1MAPK1PTGS2MAPTHTT
Bromide SCHEMBL6343986 0.69 ALDH1A1 (0.62) ALDH1A1MAPK1MAPTTDP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5681879-A BLEND OF POLYESTER, POLYHYDRIC ALCOHOL, SYNERGISTIC MIXTURE OF INORGANIC AND HALOGEN FLAME RETARDERS MITSUBISHI CHEMICAL CORPORATION (JP) 1997-10-28 — — US disclosed
EP-0691370-A2 Flame-retardant polyester resin composition Mitsubishi Chemical Corporation (JP) 1996-01-10 — — EP disclosed
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