SCHEMBL862639

SCHEMBL862639

CCCCCCCCCCOc1cc(/C=C/c2cc(CCCCCCCC)c(/C=C/c3cc(OCCCCCCCCCC)c(C)cc3OCCCCCCCCCC)cc2CCCCCCCC)c(OCCCCCCCCCC)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
RAD52 P43351 2/20 0.38
MAPK1 P28482 1/20 0.38
THRB P10828 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
THRA P10827 2/20 0.36
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CNR1 P21554 7/20 0.35
CNR2 P34972 7/20 0.35
KDM4E B2RXH2 1/20 0.35
APAF1 O14727 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 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
SCHEMBL10153560 0.94 ESR1 (0.34) ESR1MAPTNPSR1MEN1HTT
SCHEMBL12252238 0.90 ESR1 (0.43) ESR1MAPTNPSR1MEN1KMT2A
SCHEMBL862517 0.90 ESR1 (0.43) ESR1MAPTNPSR1MEN1KMT2A
SCHEMBL862614 0.87 ESR1 (0.42) ESR1MAPTNPSR1MEN1KMT2A
SCHEMBL862834 0.84 SMPD1 (0.40) ESR1THRBTHRAALOX5
SCHEMBL10153459 0.83 ESR1 (0.39) ESR1MAPTNPSR1MEN1KMT2A
SCHEMBL10153467 0.83 ESR1 (0.39) ESR1MAPTNPSR1MEN1KMT2A
SCHEMBL862607 0.83 AHR (0.42) ESR1MAPTNPSR1THRBALDH1A1
SCHEMBL862619 0.82 SMPD1 (0.41) ESR1THRBTHRAALOX5
SCHEMBL12744851 0.82 ESR1 (0.41) ESR1MAPTNPSR1MEN1KMT2A

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 6 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-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 1141/4885MAPT 4058/4885NPSR1 73/4885

“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.