SCHEMBL20148309

SCHEMBL20148309

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

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.89
CNR1 P21554 3/20 0.89
GABRA1 P14867 14/20 0.83
GABRB2 P47870 14/20 0.83
ALOX5 P09917 8/20 0.74
MEN1 O00255 2/20 0.66
GAA P10253 2/20 0.66
MAPT P10636 2/20 0.66
KMT2A Q03164 2/20 0.66
POLB P06746 1/20 0.66
GABRB1 P18505 1/20 0.66
RXRA P19793 1/20 0.66
GABRA5 P31644 1/20 0.66
GABRA3 P34903 1/20 0.66
GABRA2 P47869 1/20 0.66
ACE2 Q9BYF1 1/20 0.66
SIRT3 Q9NTG7 1/20 0.66
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
ALDH2 P05091 1/20 0.51

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
SCHEMBL20148321 0.94 CNR2 (0.95) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148308 0.93 CNR2 (0.93) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148310 0.93 CNR2 (0.93) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148305 0.93 CNR2 (0.93) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148322 0.91 GABRA1 (1.00) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148320 0.90 CNR2 (0.88) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148340 0.86 CNR2 (0.82) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL20148316 0.86 GABRA1 (0.79) CNR2CNR1GABRA1GABRB2ALOX5
Methylhonokiol SCHEMBL31046735 0.85 GABRA1 (1.00) CNR2CNR1GABRA1GABRB2ALOX5
Methylhonokiol SCHEMBL29997213 0.85 GABRA1 (1.00) CNR2CNR1GABRA1GABRB2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021212691-A1 MITOCHONDRIA TARGETING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 山东大学 (CN) 2021-10-28 WO disclosed
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 CNR2 2830/4885CNR1 3693/4885GABRA1 4171/4885

“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.