SCHEMBL9717124

SCHEMBL9717124

COCCOCCOCCOCCOCCOCCOCCOC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ABCB11 O95342 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADRA2B P18089 1/20 0.37
OPRD1 P41143 1/20 0.37
SCN5A Q14524 1/20 0.37
ALDH1A1 P00352 6/20 0.37
GAA P10253 5/20 0.37
RAB9A P51151 1/20 0.37
SERPINE1 P05121 1/20 0.33
HPGD P15428 5/20 0.32
KDM4E B2RXH2 4/20 0.32
HSD17B10 Q99714 4/20 0.32
GLA P06280 3/20 0.32
CASP1 P29466 3/20 0.32
CASP7 P55210 3/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL9222485 0.92 TSHR (0.46) TSHRABCB11CYP3A4ADRA2BOPRD1
SCHEMBL6047029 0.84 ALDH1A1 (0.44) TSHRABCB11CYP3A4ADRA2BOPRD1
SCHEMBL9717140 0.76 MAPT (0.44) TSHRCYP3A4ALDH1A1GAARAB9A
SCHEMBL9226827 0.76 ESR1 (0.46) TSHRABCB11CYP3A4ADRA2BOPRD1
SCHEMBL10627798 0.71 THRB (0.36) TSHRALDH1A1SERPINE1HSD17B10RECQL
SCHEMBL17965753 0.70 ALDH1A1 (0.48) TSHRALDH1A1HPGDKDM4EMAPT
SCHEMBL7783160 0.70 F2 (0.34) TSHRALDH1A1SERPINE1LMNAUSP2
SCHEMBL7077229 0.70 F2 (0.33) TSHRABCB11CYP3A4ADRA2BOPRD1
SCHEMBL9333587 0.69 TSHR (0.41) TSHRABCB11CYP3A4ADRA2BOPRD1
SCHEMBL8746586 0.69 TSHR (0.41) TSHRABCB11CYP3A4ADRA2BOPRD1

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
US-5162405-A Single-functional and mixtures of multi-functional oligomeric performance additive compositions and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1992-11-10 US disclosed
US-5013777-A Benzosulfonic acids as end groups of engineering thermoplastic resins; fireproofing; oxidation and UV resistances; photostabilizers ATOCHEM NORTH AMERICA, INC. (US) 1991-05-07 US disclosed
EP-0332761-A2 Single-functional and mixtures of multifunctional oligomeric performance additive compositions, and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-09-20 EP disclosed