SCHEMBL20152942

SCHEMBL20152942

C=CCc1ccc(OC(=O)OCc2ccccc2)c(-c2ccc(OC)c(CC=C)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.70
GABRA1 P14867 15/20 0.65
GABRB2 P47870 15/20 0.65
CNR2 P34972 3/20 0.65
GABRA5 P31644 1/20 0.54
GABRA3 P34903 1/20 0.54
GABRA2 P47869 1/20 0.54
MEN1 O00255 1/20 0.50
CYP3A4 P08684 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL22296373 0.90 ALOX5 (0.59) ALOX5GABRA1GABRB2CNR2GABRA5
SCHEMBL6947612 0.84 MEN1 (0.70) ALOX5MEN1CYP3A4KMT2ATDP1
SCHEMBL13978616 0.80 GABRA1 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
SCHEMBL18313888 0.77 ALOX5 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
SCHEMBL34470434 0.77 ALOX5 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
Methylhonokiol SCHEMBL29997213 0.76 GABRA1 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
Methylhonokiol SCHEMBL12391677 0.76 GABRA1 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
Methylhonokiol SCHEMBL31046735 0.76 GABRA1 (1.00) ALOX5GABRA1GABRB2CNR2GABRA5
SCHEMBL34470194 0.75 ALOX5 (0.78) ALOX5GABRA1GABRB2CNR2GABRA5
SCHEMBL13978629 0.73 GABRA1 (0.81) ALOX5GABRA1GABRB2CNR2GABRA5

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-20180134737-A1 MITO-HONOKIOL COMPOUNDS AND METHODS OF SYNTHESIS AND USE THEREOF THE MEDICAL COLLEGE OF WISCONSIN, INC. 2018-05-17 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-20180134737-A1 MITO-HONOKIOL COMPOUNDS AND METHODS OF SYNTHESIS AND USE THEREOF MFN2, MT-ND2, PCK2 ALOX5 346/4885GABRA1 4171/4885GABRB2 3927/4885

“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.