SCHEMBL6313167

SCHEMBL6313167

COc1ccc(C(=O)C(Cc2cccs2)=C(C(=O)O)c2ccc3nsnc3c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.56
EDNRB P24530 1/20 0.46

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
SCHEMBL6313164 1.00 EDNRA (0.56) EDNRAEDNRB
SCHEMBL6315284 0.86 EDNRA (0.65) EDNRA
SCHEMBL6315287 0.86 EDNRA (0.65) EDNRA
SCHEMBL7838675 0.86 EDNRA (0.67) EDNRA
SCHEMBL7838673 0.86 EDNRA (0.67) EDNRA
SCHEMBL7843006 0.85 EDNRA (0.64) EDNRA
SCHEMBL7843001 0.85 EDNRA (0.64) EDNRA
SCHEMBL6313651 0.84 EDNRA (0.56) EDNRA
SCHEMBL6313646 0.84 EDNRA (0.56) EDNRA
SCHEMBL7840524 0.83 EDNRB (0.64) EDNRAEDNRB

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-20050014769-A1 Use of endothelin receptor antogonists for the treatment of tumour diseases MERCK PATENT GMBH (DE) 2005-01-20 US claimed
US-20050014769-A1 Use of endothelin receptor antogonists for the treatment of tumour diseases MERCK PATENT GMBH (DE) 2005-01-20 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-20050014769-A1 Use of endothelin receptor antogonists for the treatment of tumour diseases EDNRA, EDNRB, ECE1 EDNRA 1/4885EDNRB 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.