SCHEMBL15728331

SCHEMBL15728331

CCOCc1cc(CO)ccc1-c1ccccc1S(=O)(=O)N(COCC[Si](C)(C)C)c1noc(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 11/20 0.42
AGTR1 P30556 3/20 0.42
EDNRB P24530 1/20 0.32

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
SCHEMBL5523918 0.92 EDNRA (0.41) EDNRAAGTR1EDNRB
SCHEMBL30171054 0.92 EDNRA (0.41) EDNRAAGTR1EDNRB
SCHEMBL535104 0.90 EDNRA (0.43) EDNRAAGTR1EDNRB
SCHEMBL30757240 0.90 EDNRA (0.43) EDNRAAGTR1EDNRB
SCHEMBL28571209 0.88 EDNRA (0.36) EDNRAAGTR1
SCHEMBL5530883 0.88 EDNRA (0.42) EDNRAAGTR1EDNRB
SCHEMBL15728330 0.88 EDNRA (0.38) EDNRAAGTR1EDNRB
SCHEMBL5523038 0.85 EDNRA (0.39) EDNRAAGTR1EDNRB
SCHEMBL5531210 0.84 EDNRA (0.41) EDNRAAGTR1EDNRB
SCHEMBL30171097 0.84 EDNRA (0.41) EDNRAAGTR1EDNRB

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-9662312-B2 Method for treating glomerulosclerosis LIGAND PHARMACEUTICALS INC. (US) 2017-05-30 US disclosed
US-20150164865-A1 ORAL FORMULATIONS OF DIPHENYLSULFONAMIDE ENDOTHELIN AND ANGIOTENSIN II RECEPTOR AGONISTS TO TREAT ELEVATED BLOOD PRESSURE AND DIABETIC NEPHROPATHY CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-06-18 US disclosed
US-20140142149-A1 ORAL FORMULATIONS OF DIPHENYLSULFONAMIDE ENDOTHELIN AND ANGIOTENSIN II RECEPTOR AGONISTS TO TREAT ELEVATED BLOOD PRESSURE AND DIABETIC NEPHROPATHY LIGAND PHARMACEUTICALS INC. (US) 2014-05-22 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-20140142149-A1 ORAL FORMULATIONS OF DIPHENYLSULFONAMIDE ENDOTHELIN AND ANGIOTENSIN II RECEPTOR AGONISTS TO TREAT ELEVATED BLOOD PRESSURE AND DIABETIC NEPHROPATHY AGTR2, EDNRB, EDNRA EDNRA 3/4885AGTR1 4/4885EDNRB 2/4885
US-20150164865-A1 ORAL FORMULATIONS OF DIPHENYLSULFONAMIDE ENDOTHELIN AND ANGIOTENSIN II RECEPTOR AGONISTS TO TREAT ELEVATED BLOOD PRESSURE AND DIABETIC NEPHROPATHY AGTR2, EDNRB, EDNRA EDNRA 3/4885AGTR1 4/4885EDNRB 2/4885

“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.