SCHEMBL19008213

SCHEMBL19008213

CCCCC[C@@H](O)/C=C/c1ccccc1/C=C/[C@@H](O)[C@@H](O)CCCC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 10/20 0.50
NFKB1 P19838 2/20 0.50
NFKB2 Q00653 2/20 0.50
RELA Q04206 2/20 0.50
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
MAPT P10636 1/20 0.38
LTB4R Q15722 2/20 0.37
CSNK1E P49674 1/20 0.36
FAAH O00519 1/20 0.36

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
Blxa4 SCHEMBL10000537 0.90 FPR2 (0.63) FPR2NFKB1NFKB2RELAMAPT
Blxa4 SCHEMBL29563817 0.90 FPR2 (0.63) FPR2NFKB1NFKB2RELAMAPT
SCHEMBL15942742 0.88 NFKB1 (0.50) FPR2NFKB1NFKB2RELA
SCHEMBL29564346 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL22956003 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL29935444 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL590255 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL590253 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL590254 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA
SCHEMBL590256 0.87 NFKB1 (0.65) FPR2NFKB1NFKB2RELA

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-20170172967-A1 Benzo Lipoxin Analogues UNIVERSITY OF SOUTHERN CALIFORNIA 2017-06-22 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-20170172967-A1 Benzo Lipoxin Analogues ALOX15B, ALOX12, ALOX15 FPR2 238/4885NFKB1 175/4885NFKB2 265/4885

“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.