SCHEMBL2005556

SCHEMBL2005556

NC(=O)CCCCOOC(N)=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 2/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LTB4R Q15722 1/20 0.31
KDM4E B2RXH2 2/20 0.31
GAA P10253 1/20 0.31
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL11018811 0.98 SOAT1 (0.36) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL25184144 0.83 SOAT1 (0.33) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL27962013 0.83 SOAT1 (0.33) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL20643480 0.82 SOAT1 (0.35) SOAT1MEN1FAAHTP53CYP1A2
Hydrochloric Acid SCHEMBL29226168 0.81 SOAT1 (0.32) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL27095249 0.81 SOAT1 (0.32) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL21902149 0.80 SOAT1 (0.38) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL439053 0.79 NAAA (0.43) MEN1CYP3A4KMT2ATSHR
SCHEMBL28747969 0.77 NAAA (0.47) MEN1CYP3A4KMT2ATSHR
SCHEMBL9277097 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240328943-A1 SUBSTRATE FUNCTIONALIZED BY NAPHTHALENE-BASED SILICA NANOPARTICLES AS A SENSOR FOR DETECTING MERCURY IONS KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2024-10-03 US disclosed
US-7964721-B2 A mercury preferential fluorescence detectors used for detecting mercury ions; microfulidic chemical analysis CHUNG-ANG UNIVERSITY INDUSTRY-ACADEMY COOPERATION FOUNDATION (KR) 2011-06-21 US disclosed
US-20080255346-A1 Ratiometric fluorescent chemosensor for selective detection of Hg (II) ions CHUNG-ANG UNIVERSITY INDUSTRY-ACADEMY COOPERATION FOUNDATION (KR) 2008-10-16 US disclosed
US-20060134244-A1 Breast health supplement and detoxification preparations TAKEMOTO ARNOLD C 2006-06-22 US disclosed
WO-2005074612-A9 SENSOR SYSTEM UNIV CASE WESTERN RESERVE (US) 2006-04-20 WO disclosed
US-20050209551-A1 Detoxification and breast health preparations TAKEMOTO ARNOLD C 2005-09-22 US disclosed
US-20050208118-A1 Preparations of encapsulated bioavailable chelating agents for detoxifying humans and animals TAKEMOTO ARNOLD C 2005-09-22 US disclosed
US-20050209170-A1 Consists of plant indoles, flavonoids, polyphenols, stilbenes, D-glucaric acid, triglycerides and phospholipids; prostate and breast cancer; for the heavy metal detoxification of humans and animals TAKEMOTO ARNOLD C 2005-09-22 US disclosed
US-20050208119-A1 Encapsulated oral chelating preparations TAKEMOTO ARNOLD C 2005-09-22 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-20240328943-A1 SUBSTRATE FUNCTIONALIZED BY NAPHTHALENE-BASED SILICA NANOPARTICLES AS A SENSOR FOR DETECTING MERCURY IONS NANS, SAMSN1, NCL SOAT1 1441/4885MEN1 159/4885FAAH 3633/4885
US-20080255346-A1 Ratiometric fluorescent chemosensor for selective detection of Hg (II) ions TRPA1, TRPM2, GRIA1 SOAT1 3169/4885MEN1 734/4885FAAH 3368/4885

“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.