SCHEMBL2053675

SCHEMBL2053675

CCCCC(CC)COc1cc(Br)c(OCC(CC)CCCC)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 8/20 0.42
CA2 P00918 1/20 0.42
MAPK1 P28482 2/20 0.41
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 2/20 0.38
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 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
SCHEMBL7645902 0.94 HTR2A (0.43) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL28083440 0.93 CYP3A4 (0.43) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL12440884 0.92 CYP3A4 (0.38) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL13429774 0.91 CYP3A4 (0.37) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL12514871 0.91 CYP3A4 (0.41) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL13429504 0.89 ALDH1A1 (0.38) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL2037739 0.87 LMNA (0.46) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL16432304 0.87 CYP3A4 (0.39) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL13429611 0.86 ALDH1A1 (0.34) CYP3A4L3MBTL1ALDH1A1CA2MAPK1
SCHEMBL13429956 0.86 ALDH1A1 (0.34) CYP3A4L3MBTL1ALDH1A1CA2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101482-A1 MOLECULAR ORGANIC CRYSTAL-BASED LABELING SYSTEM T.C. ERCIYES UNIVERSITESI (TR) 2026-05-15 WO disclosed
US-12152182-B2 Polymer nanoparticles for afterglow molecular imaging NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2024-11-26 US disclosed
CN-112321806-B Conjugated polymer containing thieno [3,4-b ] pyrazine and preparation method and application thereof 天津理工大学 2023-05-02 CN disclosed
EP-3802483-A1 CYANO-DERIVATIZED OLIGONOPHENYLACETYLENE-BASED FLUORESCENT SMALL MOLECULES SUITABLE FOR USE IN ORGANIC LIGHT-EMITTING DIODE APPLICATIONS AND THEIR USE IN ORGANIC LIGHT-EMITTING DIODE APPLICATIONS Tubitak (TR) 2021-04-14 EP disclosed
US-20210087463-A1 POLYMER NANOPARTICLES FOR AFTERGLOW MOLECULAR IMAGING NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2021-03-25 US disclosed
US-9775241-B2 Nanotube dispersants and dispersant free nanotube films therefrom UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-09-26 US disclosed
US-9642252-B2 Nanotube dispersants and dispersant free nanotube films therefrom UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-05-02 US disclosed
US-9642253-B2 Nanotube dispersants and dispersant free nanotube films therefrom UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2017-05-02 US disclosed
US-20160192484-A1 NANOTUBE DISPERSANTS AND DISPERSANT FREE NANOTUBE FILMS THEREFROM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2016-06-30 US disclosed
US-20160185602-A1 NANOTUBE DISPERSANTS AND DISPERSANT FREE NANOTUBE FILMS THEREFROM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2016-06-30 US disclosed
US-20140083752-A1 NANOTUBE DISPERSANTS AND DISPERSANT FREE NANOTUBE FILMS THEREFROM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2014-03-27 US disclosed
EP-2694579-A2 NANOTUBE DISPERSANTS AND DISPERSANT FREE NANOTUBE FILMS THEREFROM University of Florida Research Foundation, Incorporated (US) 2014-02-12 EP disclosed
US-8525131-B2 Phosphorescent organic compounds THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-09-03 US disclosed
WO-2012138632-A2 NANOTUBE DISPERSANTS AND DISPERSANT FREE NANOTUBE FILMS THEREFROM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-10-11 WO disclosed
US-20120248337-A1 PHOSPHORESCENT ORGANIC COMPOUNDS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
WO-2011066415-A2 PHOSPHORESCENT ORGANIC COMPOUNDS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-06-03 WO 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 (3 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-12152182-B2 Polymer nanoparticles for afterglow molecular imaging CD68, ALG1, MB CYP3A4 4425/4885L3MBTL1 1199/4885ALDH1A1 1491/4885
US-20120248337-A1 PHOSPHORESCENT ORGANIC COMPOUNDS PAICS, PPIP5K2, PPA1 CYP3A4 3668/4885L3MBTL1 2078/4885ALDH1A1 2605/4885
US-20210087463-A1 POLYMER NANOPARTICLES FOR AFTERGLOW MOLECULAR IMAGING CD68, ALG1, MB CYP3A4 4425/4885L3MBTL1 1199/4885ALDH1A1 1491/4885

“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.