SCHEMBL14700607

SCHEMBL14700607

C=C(C)C(=O)OCCCCCCCCCCOc1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.68
POLB P06746 1/20 0.68
APEX1 P27695 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
TSHR P16473 2/20 0.51
GAA P10253 1/20 0.47
RARB P10826 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
HDAC3 O15379 5/20 0.46
HDAC4 P56524 5/20 0.46
HDAC1 Q13547 5/20 0.46
HDAC7 Q8WUI4 5/20 0.46
HDAC2 Q92769 5/20 0.46
HDAC10 Q969S8 5/20 0.46
HDAC11 Q96DB2 5/20 0.46
HDAC8 Q9BY41 5/20 0.46
HDAC6 Q9UBN7 5/20 0.46
HDAC9 Q9UKV0 5/20 0.46

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
SCHEMBL12918799 0.96 HTT (0.74) HTTPOLBAPEX1TDP1TSHR
SCHEMBL12114905 0.96 HTT (0.74) HTTPOLBAPEX1TDP1TSHR
SCHEMBL13289974 0.94 HTT (0.76) HTTPOLBAPEX1TDP1TSHR
SCHEMBL13220831 0.94 HTT (0.76) HTTPOLBAPEX1TDP1TSHR
SCHEMBL16982216 0.94 HTT (0.76) HTTPOLBAPEX1TDP1TSHR
SCHEMBL13899686 0.94 HTT (0.71) HTTPOLBAPEX1TDP1TSHR
SCHEMBL14400544 0.93 HTT (0.73) HTTPOLBAPEX1TDP1TSHR
SCHEMBL4191440 0.91 HTT (0.67) HTTPOLBAPEX1TDP1TSHR
SCHEMBL13572524 0.90 POLB (0.64) HTTPOLBAPEX1TDP1TSHR
SCHEMBL5485944 0.90 HTT (0.70) HTTPOLBAPEX1TDP1TSHR

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-20130037752-A1 ELECTROLUMINESCENT MATERIALS COMPRISING FLUORENE DERIVATIVES LOMOX LIMITED (GB) 2013-02-14 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-20130037752-A1 ELECTROLUMINESCENT MATERIALS COMPRISING FLUORENE DERIVATIVES SPIN2B, FLNB, LMNB2 HTT 3101/4885POLB 279/4885APEX1 917/4885

“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.