SCHEMBL339836

SCHEMBL339836

CCCCCCCCCCOc1cc(Br)c(OCCCCCCCCCC)cc1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 4/20 0.49
THRB P10828 4/20 0.49
S1PR3 Q99500 2/20 0.45
S1PR2 O95136 1/20 0.45
S1PR1 P21453 1/20 0.45
LPAR2 Q9HBW0 1/20 0.45
SMPD1 P17405 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PTPN11 Q06124 1/20 0.43
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
TLR8 Q9NR97 1/20 0.42
NR5A1 Q13285 1/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42

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
SCHEMBL339687 1.00 THRA (0.49) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL2049161 1.00 THRA (0.49) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL197292 1.00 THRA (0.49) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL2053781 1.00 THRA (0.49) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL2038965 0.98 THRA (0.47) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL25340169 0.94 THRA (0.48) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL3854108 0.92 THRA (0.48) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL3858144 0.92 THRA (0.48) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL3852512 0.92 THRA (0.45) THRATHRBS1PR3S1PR2S1PR1
SCHEMBL4604305 0.92 SMPD1 (0.49) THRATHRBS1PR3S1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4631926-A1 METHOD FOR PRODUCING HOMO-COUPLING REACTION PRODUCT National University Corporation Hokkaido University (JP) 2025-10-15 EP disclosed
US-8097348-B2 Pi-conjugated organoboron polymers in thin-film organic electronic devices TDA RESEARCH, INC. (US) 2012-01-17 US disclosed
US-8012603-B2 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-06 US disclosed
US-20090127547-A1 PI-CONJUGATED ORGANOBORON POLYMERS IN THIN-FILM ORGANIC ELECTRONIC DEVICES TDA RESEARCH, INC. 2009-05-21 US disclosed
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-06-12 US disclosed
US-20070215864-A1 Use of pi-conjugated organoboron polymers in thin-film organic polymer electronic devices TDA RESEARCH, INC. 2007-09-20 US disclosed
US-20050119491-A1 2, 7-Substituted carbazoles and oligomers, polymers and co-polymers thereof SHEFFIELD, THE UNIVERSITY OF (GB) 2005-06-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties BRS3, SLC43A1, MRPS23 THRA 2652/4885THRB 2657/4885S1PR3 376/4885
US-20050119491-A1 2, 7-Substituted carbazoles and oligomers, polymers and co-polymers thereof CBR3, OR10J3, ORC3 THRA 4127/4885THRB 3597/4885S1PR3 1463/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.