SCHEMBL17014264

SCHEMBL17014264

CC(C)(C)c1ccc(C(C)(C)C)c2c1OCC21CCCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.33
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31

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
SCHEMBL17014544 0.93 PTGS1 (0.33) ALOX5PTGS1PTGS2
SCHEMBL17014255 0.85
SCHEMBL21845221 0.77 PTGS1 (0.38) ALOX5PTGS1PTGS2
SCHEMBL13058874 0.75 PTGS1 (0.33) ALOX5PTGS1PTGS2
SCHEMBL21845219 0.72 PTGS1 (0.40) ALOX5PTGS1PTGS2
SCHEMBL17019676 0.69 PDE7A (0.30)
SCHEMBL24184947 0.69 PTGS1 (0.33) ALOX5PTGS1PTGS2
SCHEMBL15746194 0.68 ALDH1A1 (0.35)
SCHEMBL24184945 0.68 PTGS1 (0.32) ALOX5PTGS1PTGS2
SCHEMBL15746196 0.67 ALDH1A1 (0.38)

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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-08-20 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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS HAVCR2, SLC10A1, SORD ALOX5 2894/4885PTGS1 1177/4885PTGS2 2436/4885

“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.