SCHEMBL13635968

SCHEMBL13635968

CCCOC(=O)C(C)(COC(=O)C(C)(CO)CO)COC(=O)C(C)(CO)CO

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
GRM1 Q13255 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
PRKCA P17252 1/20 0.31
ESR1 P03372 1/20 0.31
CHRM1 P11229 1/20 0.31
TSHR P16473 1/20 0.31
SLC6A2 P23975 1/20 0.31
KDR P35968 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP4F2 P78329 2/20 0.30
CYP4A11 Q02928 2/20 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
SCHEMBL15334588 1.00 HCAR2 (0.33) HCAR2LMNAALDH1A1HSD17B10GRM1
SCHEMBL9870240 0.92 HCAR2 (0.38) HCAR2LMNAALDH1A1HSD17B10GRM1
SCHEMBL13785294 0.90 PRKCA (0.33) PRKCA
SCHEMBL14448141 0.87 PRKCA (0.33) KDM4EPKMPRKCA
SCHEMBL16348119 0.86 TSHR (0.33) PRKCATSHRCYP4F2CYP4A11
SCHEMBL13785308 0.86 HCAR2 (0.34) HCAR2LMNAALDH1A1HSD17B10GRM1
SCHEMBL18028242 0.86 ALDH1A1 (0.33) HCAR2LMNAALDH1A1GRM1ESR1
SCHEMBL18679884 0.86 NAAA (0.46) HCAR2LMNAALDH1A1TSHR
SCHEMBL2615570 0.85 CYP4F2 (0.33) ALDH1A1HSD17B10PRKCATSHRCYP4F2
SCHEMBL2615566 0.85 CYP4F2 (0.33) ALDH1A1HSD17B10PRKCATSHRCYP4F2

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-8562953-B2 Dendritic polymers and magnetic resonance imaging contrast agent employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-10-22 US disclosed
US-20130030139-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-31 US disclosed
US-20130030139-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-31 US disclosed
US-8303937-B2 Dendritic polymers and magnetic resonance imaging contrast agent employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-11-06 US disclosed
US-8303937-B2 Dendritic polymers and magnetic resonance imaging contrast agent employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-11-06 US disclosed
US-20090169481-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-07-02 US disclosed
US-20090169481-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-07-02 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-20090169481-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME DCLK1, MSR1, S1PR3 HCAR2 3785/4885LMNA 2032/4885ALDH1A1 4783/4885

“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.