SCHEMBL13604351

SCHEMBL13604351

CCCOCCOCCOCCOCCOCCOCC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.61
ALDH1A1 P00352 7/20 0.39
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 2/20 0.36
HSD17B10 Q99714 2/20 0.36
THRB P10828 2/20 0.34
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
CYP3A4 P08684 1/20 0.32
EPHX2 P34913 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL12900402 1.00 CES2 (0.61) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL26279698 1.00 CES2 (0.61) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL16329739 1.00 CES2 (0.61) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL13971269 1.00 CES2 (0.61) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL8383900 0.95
SCHEMBL17174610 0.91 CES2 (0.69) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL6259731 0.91 CES2 (0.76) CES2ALDH1A1TSHRTHRBMEN1
SCHEMBL22198415 0.89 CES2 (0.58) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL20932195 0.89 CES2 (0.58) CES2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL26279694 0.89 CES2 (0.58) CES2ALDH1A1TSHRTDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216166-B2 Anti-microbial photodynamic therapy Biolitec Pharma Marketing, Ltd (MY) 2015-12-22 US disclosed
US-20090326434-A1 Anti-Microbial Photodynamic Therapy BIOLITEC UNTERNEHMENSBETEILIGUNGS II AG (AT) 2009-12-31 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-20090326434-A1 Anti-Microbial Photodynamic Therapy CD47, EPOR, ENPEP CES2 2224/4885ALDH1A1 1139/4885TSHR 914/4885

“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.