SCHEMBL6065023

SCHEMBL6065023

CCCCCCCCCCCCSc1ccccc1CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 7/20 0.56
CYSLTR1 Q9Y271 7/20 0.56
PTGS2 P35354 5/20 0.56
EPHX2 P34913 1/20 0.50
CDC25A P30304 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.45
AKR1B1 P15121 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL27261843 1.00 CYSLTR2 (0.56) CYSLTR2CYSLTR1PTGS2EPHX2CDC25A
SCHEMBL202369 0.79 PTGS2 (0.54) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL199656 0.79 PTGS2 (0.54) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL10888245 0.79 PTGS2 (0.54) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL11768735 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL12080328 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL11769795 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL11301411 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL231917 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2
SCHEMBL9139729 0.78 PTGS2 (0.58) CYSLTR2CYSLTR1PTGS2EPHX2

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-20060247458-A1 Process for the production of optically active compounds having substituents at the 2-position KANEKA CORPORATION (JP) 2006-11-02 US disclosed
EP-1600438-A1 PROCESSES FOR THE PRODUCTION OF OPTICALLY ACTIVE COMPOUNDS HAVING SUBSTITUENTS AT THE 2-POSITION KANEKA CORPORATION (JP) 2005-11-30 EP 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-20060247458-A1 Process for the production of optically active compounds having substituents at the 2-position TST, TMT1A, OSGEP CYSLTR2 395/4885CYSLTR1 750/4885PTGS2 986/4885

“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.