SCHEMBL104185

SCHEMBL104185

CCCCCCCCCc1ccc(OP(O)Oc2cccc(CCCCCCCCC)c2CCCCCCCCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
ALOX5 P09917 1/20 0.43
PPARA Q07869 2/20 0.41
LTB4R Q15722 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
CYP3A4 P08684 2/20 0.40
PPARG P37231 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SHBG P04278 1/20 0.40
TP53 P04637 1/20 0.40
HSPD1 P10809 1/20 0.40

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
SCHEMBL30143556 1.00 PTGS2 (0.43) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL14686026 0.90 PTGS2 (0.51) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL10348809 0.88 PTGS2 (0.53) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL8656876 0.88 PTGS2 (0.42) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL9325512 0.86 THRA (0.51) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL449156 0.85 LTB4R (0.44) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL11309656 0.85 THRA (0.50) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL28621008 0.84 ALOX5 (0.46) PTGS2ALOX5PPARALTB4RLTB4R2
SCHEMBL8433697 0.83 ALDH1A1 (0.56) PTGS2PPARAESR1ADRA2AADORA3
SCHEMBL5600659 0.83 ALDH1A1 (0.56) PTGS2PPARAESR1ADRA2AADORA3

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
CN-115210340-A Flame retardant composition for expanded styrene resin, flame-retardant expanded styrene resin composition, and extruded foam molded article thereof 第一工业制药株式会社 2022-10-18 CN disclosed
WO-2022168564-A1 FLAME RETARDANT COMPOSITION FOR FOAMED STYRENE RESIN, FLAME-RETARDANT FOAMED STYRENE-BASED RESIN COMPOSITION, AND EXTRUSION FOAM-MOLDED PRODUCT OF SAME 第一工業製薬株式会社 2022-08-11 WO disclosed
CN-111032755-A Flame-retardant expandable styrene resin composition 第一工业制药株式会社 2020-04-17 CN disclosed
EP-2426165-B1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2016-06-29 EP disclosed
US-9187607-B2 Flame-retarded foamable styrene-based resin compositions DAI-ICHI KOGYO SEIYAKU, CO., LTD. (JP) 2015-11-17 US disclosed
EP-1983028-B1 FLAME-RETARDANT STYRENE RESIN COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2012-08-15 EP disclosed
EP-2426165-A1 FLAME-RETARDANT EXPANDABLE STYRENE RESIN COMPOSITION Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) 2012-03-07 EP 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