SCHEMBL13201489

SCHEMBL13201489

COC(=O)NC(C#C[Si](C)(C)C)(CN1CCc2cc(OC)ccc2C1=O)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 7/20 0.40
ITGB3 P05106 11/20 0.39
ITGA2B P08514 11/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39

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
SCHEMBL13201492 0.93 DRD2 (0.41) ITGB3ITGA2B
SCHEMBL8227926 0.87 AOC3 (0.44) AOC3ITGB3ITGA2BPRMT5WDR77
SCHEMBL13201487 0.83 TNF (0.48) AOC3ITGB3ITGA2BPRMT5WDR77
SCHEMBL10201462 0.81 HTR1A (0.33)
SCHEMBL10201463 0.81 HTR1A (0.33)
SCHEMBL13201493 0.80 DRD2 (0.43) AOC3ITGB3ITGA2B
SCHEMBL10112103 0.78 ADAM17 (0.43)
SCHEMBL10112013 0.78 ADAM17 (0.43)
SCHEMBL13895587 0.77 ADAM17 (0.34)
SCHEMBL13201500 0.77 ADAM17 (0.41) ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772263-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2010-08-10 US disclosed
US-20090156586-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION 2009-06-18 US disclosed
US-7524842-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-04-28 US disclosed
US-20070197564-A1 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION 2007-08-23 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 (2 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-20090156586-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS ADAMTS1, ADAMTS13, ADAMTS7 AOC3 1859/4885ITGB3 1884/4885ITGA2B 1670/4885
US-20070197564-A1 Compounds for the treatment of inflammatory disorders ADAMTS1, ADAMTS13, ADAMTS7 AOC3 1859/4885ITGB3 1884/4885ITGA2B 1670/4885

“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.