SCHEMBL7007227

SCHEMBL7007227

CCOC(=O)CCCCC(C=Cc1ccccc1OCCCCCc1ccccc1)Cc1ccc(C#N)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.38
CTSG P08311 3/20 0.38
CMA1 P23946 3/20 0.38
ALOX5 P09917 1/20 0.38
FFAR1 O14842 1/20 0.37
FAAH O00519 1/20 0.37
S1PR1 P21453 1/20 0.37
CYP4Z1 Q86W10 1/20 0.36
PPARG P37231 1/20 0.35
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35

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
SCHEMBL7006251 0.94 LTA4H (0.39) LTA4HALOX5FAAHS1PR1CYP4Z1
SCHEMBL7013170 0.90 FFAR1 (0.45) FFAR1FAAHS1PR1CYSLTR2CYSLTR1
SCHEMBL2293422 0.84 CTSG (0.37) CTSGCMA1S1PR1
SCHEMBL2293418 0.84 CTSG (0.37) CTSGCMA1S1PR1
SCHEMBL4510764 0.84 FFAR1 (0.43) FFAR1FAAHS1PR1CYSLTR2CYSLTR1
SCHEMBL4510771 0.84 FFAR1 (0.43) FFAR1FAAHS1PR1CYSLTR2CYSLTR1
SCHEMBL4602072 0.84 GAA (0.37) LTA4HCTSGCMA1CYP4Z1
SCHEMBL2291756 0.84 GAA (0.37) LTA4HCTSGCMA1CYP4Z1
SCHEMBL2291750 0.84 GAA (0.37) LTA4HCTSGCMA1CYP4Z1
SCHEMBL8240110 0.84 RAB9A (0.42) CTSGCMA1ALOX5FFAR1FAAH

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
US-8183271-B2 Tetrazole derivatives and their use for the treatment of cardiovascular diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-05-22 US disclosed
US-20090215843-A1 Tetrazole Derivatives and Their Use for the Treatment of Cardiovascular Diseases BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-08-27 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-20090215843-A1 Tetrazole Derivatives and Their Use for the Treatment of Cardiovascular Diseases TNNI3, TNNT2, FABP3 LTA4H 1798/4885CTSG 1721/4885CMA1 1331/4885

“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.