SCHEMBL20148306

SCHEMBL20148306

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

nearest known ligand 0.87

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 15/20 0.87
GABRB2 P47870 15/20 0.87
CNR2 P34972 5/20 0.78
CNR1 P21554 2/20 0.78
ALOX5 P09917 7/20 0.63
MEN1 O00255 1/20 0.63
POLB P06746 1/20 0.63
GAA P10253 1/20 0.63
MAPT P10636 1/20 0.63
GABRB1 P18505 1/20 0.63
RXRA P19793 1/20 0.63
GABRA5 P31644 1/20 0.63
GABRA3 P34903 1/20 0.63
GABRA2 P47869 1/20 0.63
KMT2A Q03164 1/20 0.63
ACE2 Q9BYF1 1/20 0.63
SIRT3 Q9NTG7 1/20 0.63

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
SCHEMBL22296371 1.00 GABRA1 (0.87) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148307 1.00 GABRA1 (0.87) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL22296368 1.00 GABRA1 (0.87) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148313 1.00 GABRA1 (0.87) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148319 0.99 GABRA1 (0.89) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL22296367 0.97 GABRA1 (0.89) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148322 0.93 GABRA1 (1.00) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148310 0.91 CNR2 (0.93) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148308 0.91 CNR2 (0.93) GABRA1GABRB2CNR2CNR1ALOX5
SCHEMBL20148305 0.91 CNR2 (0.93) GABRA1GABRB2CNR2CNR1ALOX5

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 GABRA1 4171/4885GABRB2 3927/4885CNR2 2830/4885

“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.