SCHEMBL6410095

SCHEMBL6410095

CCC(=O)OCCCS(=O)(=O)O.[KH]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
HTT P42858 1/20 0.44
APP P05067 1/20 0.37
DGKA P23743 1/20 0.35
GAA P10253 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAD52 P43351 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CA2 P00918 2/20 0.33
FAAH O00519 1/20 0.33
DNM1 Q05193 1/20 0.33
KDM4E B2RXH2 1/20 0.33
EPHX2 P34913 1/20 0.33
HTR2C P28335 1/20 0.33
HPGD P15428 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
WRN Q14191 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL10172806 0.98 NAAA (0.55) NAAAHTTAPPDGKAGAA
SCHEMBL10172836 0.92 NAAA (0.59) NAAAHTTAPPDGKAGAA
Propionic Acid SCHEMBL27519317 0.85 NAAA (0.56) NAAAHTTDGKARAD52NPSR1
SCHEMBL13331043 0.85 NAAA (0.48) NAAAHTTAPPDGKAGAA
SCHEMBL28245871 0.83 NAAA (0.47) NAAAHTTAPPDGKAGAA
SCHEMBL28517022 0.82 DGKA (0.47) NAAAAPPDGKAALDH1A1RAD52
SCHEMBL4353576 0.81 APP (0.41) NAAAAPPDGKAGAACA2
SCHEMBL16693727 0.81 DGKA (0.55) NAAADGKAALDH1A1RAD52NPSR1
SCHEMBL20008841 0.80 NAAA (0.53) NAAAHTTDGKAGAAALDH1A1
SCHEMBL16316349 0.79 NAAA (0.41) NAAAHTTGAARAD52NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1708765-B1 BIOCOMPATIBLE POLYMERIZATION ACCELERATORS SURMODICS INC (US) 2016-08-31 EP disclosed
US-8202833-B2 Coating of polymer containing N-vinyl groups on cells, tissue SURMODICS, INC. (US) 2012-06-19 US disclosed
US-20050112086-A1 Biocompatible polymerization accelerators SURMODICS, INC. 2005-05-26 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-20050112086-A1 Biocompatible polymerization accelerators VCL, PCNA, CD38 NAAA 716/4885HTT 2657/4885APP 3132/4885

“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.