SCHEMBL94551

SCHEMBL94551

O=C(O)c1cc(C(=O)OCC(Br)CBr)c(C(=O)OCC(Br)CBr)cc1C(=O)OCC(Br)CBr

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.36
TSHR P16473 3/20 0.36
MAPK1 P28482 1/20 0.35
CA2 P00918 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.32
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
SERPINE1 P05121 1/20 0.30
HSD17B10 Q99714 1/20 0.30
LMNA P02545 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
SCHEMBL4811737 0.93 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL10402323 0.85 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1MAPTHSD17B10
SCHEMBL28237115 0.85 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL29600986 0.83 ALDH1A1 (0.54) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL28004362 0.83 ALDH1A1 (0.54) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL4064413 0.79 ALDH1A1 (0.57) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL4810190 0.79 ALDH1A1 (0.59) ALDH1A1TSHRMAPK1CA2CYP3A4
SCHEMBL4059190 0.78 SERPINE1 (0.44) ALDH1A1TSHRMAPK1CA2MAPT
SCHEMBL829115 0.77 ALDH1A1 (0.61) ALDH1A1TSHRMAPK1MAPT
SCHEMBL828836 0.77 ALDH1A1 (0.61) ALDH1A1TSHRMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10633502-B2 Flame-retardant foamable styrene resin composition DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2020-04-28 US disclosed
EP-2998347-B1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2018-06-06 EP disclosed
EP-2998347-A1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN COMPOSITION Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) 2016-03-23 EP disclosed
US-20160075843-A1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN COMPOSITION DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2016-03-17 US disclosed
EP-1983028-B1 FLAME-RETARDANT STYRENE RESIN COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2012-08-15 EP disclosed
EP-2426152-A1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN PARTICLES AND METHOD FOR PRODUCING SAME Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) 2012-03-07 EP disclosed
US-20110319507-A1 FLAME-RETARDED FOAMABLE STYRENE-BASED RESIN BEADS AND PROCESS FOR PRODUCING THE SAME DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2011-12-29 US disclosed
US-20100168263-A1 FLAME-RETARDED STYRENE-BASED RESIN COMPOSITIONS DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2010-07-01 US disclosed
EP-1983028-A1 FLAME-RETARDANT STYRENE RESIN COMPOSITION Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) 2008-10-22 EP disclosed