SCHEMBL2289546

SCHEMBL2289546

CCCCCCOC(=O)CC(N=C=O)C(=O)OCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
NPSR1 Q6W5P4 2/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RAD52 P43351 1/20 0.44
FAAH O00519 2/20 0.43
DGKA P23743 1/20 0.42
HTR2C P28335 1/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
EPHX1 P07099 1/20 0.40
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL16542989 0.86 NAAA (0.46) NAAANPSR1RAD52FAAHDGKA
SCHEMBL27529753 0.83 NAAA (0.43) NAAANPSR1RAD52FAAHHTR2C
SCHEMBL11438850 0.81 MAPT (0.43) NAAANPSR1MAPTRAD52DGKA
SCHEMBL11237496 0.80 NAAA (0.38) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL25964438 0.79 DGKA (0.42) NAAANPSR1MAPTMAPK1RAD52
SCHEMBL25964471 0.79 DGKA (0.42) NAAANPSR1MAPTMAPK1RAD52
SCHEMBL11443787 0.78 MAPT (0.43) NAAAMAPTFAAHDGKAEPHX1
SCHEMBL10451644 0.78 ALDH1A1 (0.42) NAAAMAPTMAPK1L3MBTL1EPHX1
SCHEMBL16710359 0.78 ALDH1A1 (0.42) NAAAMAPTMAPK1L3MBTL1EPHX1
SCHEMBL9016837 0.75 NAAA (0.62) NAAANPSR1MAPTMAPK1L3MBTL1

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-9115218-B2 Anionic polysaccharides functionalized by at least two hydrophobic groups carried by an at least trivalent spacer ADOCIA (FR) 2015-08-25 US disclosed
US-20110195913-A1 Anionic polysaccharides functionalized by at least two hydrophobic groups carried by an at least trivalent spacer ADOCIA (FR) 2011-08-11 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-20110195913-A1 Anionic polysaccharides functionalized by at least two hydrophobic groups carried by an at least trivalent spacer CD44, CSGALNACT1, ALG1 NAAA 1091/4885NPSR1 1566/4885MAPT 3199/4885

“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.