SCHEMBL7064949

SCHEMBL7064949

CCCCCCCCOc1cc(C(Cl)Cl)c(OCCCCCCCC)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.47
THRA P10827 3/20 0.47
ESR1 P03372 2/20 0.42
PTPN11 Q06124 2/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
PPARG P37231 3/20 0.39
PPARA Q07869 2/20 0.39
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
S1PR2 O95136 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
MCHR1 Q99705 1/20 0.35
TLR8 Q9NR97 1/20 0.35
CYP1A2 P05177 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
SCHEMBL862599 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL15200209 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL13475571 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL14570401 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL10039089 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL13475563 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL862816 0.84 ESR1 (0.51) THRBTHRAESR1ALDH1A1HPGD
SCHEMBL4295205 0.84 THRA (0.47) THRBTHRAESR1PTPN11PTPN1
Bromide SCHEMBL4295206 0.82 ESR1 (0.50) THRBTHRAESR1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL7064952 0.82 ESR1 (0.50) THRBTHRAESR1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0725120-B2 Polymeric fluorescent substance, production process thereof and organic electroluminescence device SUMITOMO CHEMICAL CO (JP) 2003-05-28 EP disclosed
US-5821002-A POLYARYLENEVINYLENE DERIVATIVES SUMITOMO CHEMICAL COMPANY (JP) 1998-10-13 US disclosed
EP-0725120-B1 Polymeric fluorescent substance, production process thereof and organic electroluminescence device SUMITOMO CHEMICAL CO (JP) 1998-08-19 EP disclosed
EP-0725120-A1 Polymeric fluorescent substance, production process thereof and organic electroluminescence device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-08-07 EP disclosed