SCHEMBL20110392

SCHEMBL20110392

C=C(C)C(=O)OCCOCCOc1ccc(C2(c3ccc(OCCOCCOC(=O)C(C)C)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
THRB P10828 2/20 0.36
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
PDK2 Q15119 6/20 0.33
TP53 P04637 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
SCHEMBL14889149 0.94 POLB (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL157502 0.90 POLB (0.48) POLBAPEX1HTTTDP1THRB
SCHEMBL30800968 0.90 POLB (0.48) POLBAPEX1HTTTDP1THRB
SCHEMBL20110391 0.87 KDM4E (0.34) POLBAPEX1HTTTDP1THRB
SCHEMBL4205858 0.86 POLB (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL13878666 0.86 POLB (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL534652 0.86 POLB (0.50) POLBAPEX1HTTTDP1KDM4E
SCHEMBL24469748 0.86 PDK2 (0.40) POLBAPEX1HTTTDP1THRB
SCHEMBL4251695 0.85 POLB (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL534807 0.85 POLB (0.53) POLBAPEX1HTTTDP1KDM4E

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-20180119014-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL POLYMERIZED FILMS JNC CORPORATION (JP) 2018-05-03 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-20180119014-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL POLYMERIZED FILMS NAP1L1, CCNA1, NAP1L4 POLB 1874/4885APEX1 1464/4885HTT 3256/4885

“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.