SCHEMBL18823965

SCHEMBL18823965

C=C(C)C(=O)OCCOC(=O)CCN(CCCN(C)CCCN(CCC(=O)OCCOC(=O)C(=C)C)CCC(=O)OCCOC(=O)C(=C)C)CCC(=O)OCCOC(=O)C(=C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.44
TSHR P16473 3/20 0.42
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
DNM1 Q05193 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
DGKA P23743 1/20 0.35
LTA4H P09960 5/20 0.34
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
KDM5A P29375 2/20 0.32
ALDH1A1 P00352 1/20 0.32
THRA P10827 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
SCHEMBL18823962 0.93 THRB (0.42) THRBTSHRPOLBAPEX1HTT
SCHEMBL2600105 0.88 TSHR (0.54) THRBTSHRPOLBAPEX1HTT
SCHEMBL18823964 0.88 THRB (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL12912817 0.84 TSHR (0.57) THRBTSHRPOLBAPEX1HTT
SCHEMBL18823968 0.84 THRB (0.32) THRBTSHR
SCHEMBL16977630 0.83 THRB (0.40) THRBTSHRPOLBAPEX1HTT
SCHEMBL27261784 0.83 THRB (0.51) THRBTSHRPOLBAPEX1HTT
SCHEMBL20505202 0.82 THRB (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL15759032 0.82 THRB (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL16977422 0.82 THRB (0.39) THRBTSHRPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170121279-A1 LIPOCATIONIC DENDRIMERS AND USES THEREOF THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-05-04 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-20170121279-A1 LIPOCATIONIC DENDRIMERS AND USES THEREOF LIPA, LIPC, TLR9 THRB 3413/4885TSHR 3143/4885POLB 161/4885

“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.