SCHEMBL6314775

SCHEMBL6314775

COc1ccc(Cn2c(=O)c(C(=O)O)c(-c3ccc4c(c3)OCO4)c3ccccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 15/20 1.00
EDNRA P25101 10/20 0.64

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
SCHEMBL6315734 0.90 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6312676 0.89 EDNRB (0.80) EDNRBEDNRA
SCHEMBL8900846 0.88 EDNRA (0.81) EDNRBEDNRA
SCHEMBL8798982 0.88 EDNRB (0.78) EDNRBEDNRA
SCHEMBL6315635 0.87 EDNRB (1.00) EDNRBEDNRA
SCHEMBL8902335 0.83 EDNRB (0.80) EDNRBEDNRA
SCHEMBL6315259 0.82 EDNRB (0.77) EDNRBEDNRA
SCHEMBL6321016 0.82 EDNRB (0.77) EDNRBEDNRA
SCHEMBL8578754 0.81 EDNRB (0.83) EDNRBEDNRA
SCHEMBL8901534 0.81 EDNRB (0.69) EDNRBEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1585636-A Use of endothelin receptor antagonists in the treatment of tumour diseases MERCK PATENT GMBH (DE) 2005-02-23 CN claimed
US-20050014769-A1 Use of endothelin receptor antogonists for the treatment of tumour diseases MERCK PATENT GMBH (DE) 2005-01-20 US claimed
EP-0757039-A1 Endothelin receptor antagonists MERCK PATENT GmbH (DE) 1997-02-05 EP claimed
CN-1585636-A Use of endothelin receptor antagonists in the treatment of tumour diseases MERCK PATENT GMBH (DE) 2005-02-23 CN disclosed
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 EDNRB 2/4885EDNRA 1/4885

“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.