SCHEMBL5112013

SCHEMBL5112013

COc1ccc2c(c1)c(CC(=O)NC(C)C)c(C)n2C(=O)c1ccc(Cl)cc1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 18/20 0.84
▸ PTGS1 P23219 1/20 0.81

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
Oxametacin SCHEMBL29378857 0.90 PTGS1 (1.00) PTGS2PTGS1
SCHEMBL14405006 0.90 PTGS2 (1.00) PTGS2PTGS1
Oxametacin SCHEMBL24552 0.90 PTGS1 (1.00) PTGS2PTGS1
SCHEMBL15709179 0.89 PTGS2 (0.89) PTGS2PTGS1
SCHEMBL9657228 0.89 PTGS1 (0.85) PTGS2PTGS1
SCHEMBL20259394 0.89 PTGS2 (0.83) PTGS2PTGS1
SCHEMBL11836498 0.89 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL11845952 0.89 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL11845946 0.89 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL23752275 0.89 PTGS2 (1.00) PTGS2PTGS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414067-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2008-08-19 — — US disclosed
US-7414067-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2008-08-19 — — US disclosed
US-20060069256-A1 Ophthalmic compositions for treating ocular hypertension EVOTEC OAI (GB) 2006-03-30 — — 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-20060069256-A1 Ophthalmic compositions for treating ocular hypertension KCNN1, KCNN3, KCNN2 PTGS2 122/4885PTGS1 68/4885

“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.

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