SCHEMBL15078764

SCHEMBL15078764

CCCCOCCCOc1cccc([C@H](O)CC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.47
LTB4R Q15722 1/20 0.47
PTGES O14684 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
CYSLTR2 Q9NS75 4/20 0.46
CYSLTR1 Q9Y271 4/20 0.46
MAPK1 P28482 2/20 0.46
TSHR P16473 2/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46
CYP2C19 P33261 1/20 0.46
HIF1A Q16665 1/20 0.46
CACNA1B Q00975 1/20 0.46
MEN1 O00255 1/20 0.46
GMNN O75496 1/20 0.46
ALDH1A1 P00352 1/20 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
SCHEMBL15016887 0.90 ALOX5 (0.56) ALOX5CYSLTR2CYSLTR1MAPK1TSHR
SCHEMBL15078762 0.89 ALOX5 (0.48) ALOX5LTB4RPTGESPPARGPPARA
SCHEMBL16451181 0.85 ALOX5 (0.47) ALOX5LTB4RCYSLTR2CYSLTR1MAPK1
SCHEMBL17805709 0.85 ALOX5 (0.47) ALOX5LTB4RCYSLTR2CYSLTR1MAPK1
SCHEMBL15078749 0.84 PLA2G2A (0.42) ALOX5LTB4RCYSLTR2CYSLTR1MAPK1
SCHEMBL4572157 0.84 MAPK1 (0.50) ALOX5LTB4RCYSLTR2CYSLTR1MAPK1
SCHEMBL29818894 0.84 LMNA (0.45) ALOX5CYSLTR2CYSLTR1MAPK1TSHR
SCHEMBL18175239 0.84 ALOX5 (0.50) ALOX5LTB4RPTGESPPARGPPARA
SCHEMBL15078760 0.83 TLR4 (0.48) ALOX5LTB4RPTGESPPARGPPARA
SCHEMBL4572161 0.83 ALOX5 (0.46) ALOX5LTB4RCYSLTR2CYSLTR1MAPK1

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-20130165411-A1 TRICYCLIC BORON COMPOUNDS FOR ANTIMICROBIAL THERAPY MICURX PHARMACEUTICALS, INC. (KY) 2013-06-27 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-20130165411-A1 TRICYCLIC BORON COMPOUNDS FOR ANTIMICROBIAL THERAPY TBCA, TBCB, BTD ALOX5 4065/4885LTB4R 2714/4885PTGES 4621/4885

“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.