SCHEMBL862517

SCHEMBL862517

CCCCCCCCOc1cc(/C=C/c2cc(OCCCCCCCC)c(C)cc2OCCCCCCCC)c(OCCCCCCCC)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.43
THRB P10828 3/20 0.41
THRA P10827 2/20 0.41
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
MCHR1 Q99705 1/20 0.37
TLR8 Q9NR97 1/20 0.37
RARB P10826 1/20 0.36
S1PR5 Q9H228 2/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36

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
SCHEMBL12252238 1.00 ESR1 (0.43) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL862614 0.97 ESR1 (0.42) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL862834 0.94 SMPD1 (0.40) ESR1THRBTHRACYP3A4
SCHEMBL10153467 0.92 ESR1 (0.39) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL10153459 0.92 ESR1 (0.39) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL862607 0.92 AHR (0.42) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL13377601 0.92 ESR1 (0.41) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL12744851 0.92 ESR1 (0.41) ESR1THRBTHRAALDH1A1MAPT
SCHEMBL862619 0.92 SMPD1 (0.41) ESR1THRBTHRAS1PR2S1PR1
SCHEMBL862639 0.90 ESR1 (0.38) ESR1THRBTHRAALDH1A1MAPT

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
US-8142908-B2 Polymer light-emitting material comprising a conjugated polymer and compound exhibiting light emission from the triplet excited state and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-27 US disclosed
US-8012603-B2 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-06 US disclosed
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-06-12 US disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 US disclosed
US-20070051922-A1 Polymer light-emitting material and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-08 US disclosed
US-20070040164-A1 Polymer complex compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-02-22 US disclosed
US-7157154-B2 Organoboron polymers; photoconductivity; inks; thin films; semiconductors; surface light sources; dot matrix displays SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-01-02 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 (1 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 ESR1 1141/4885THRB 2657/4885THRA 2652/4885

“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.