SCHEMBL6708961

SCHEMBL6708961

COC(=O)C(Oc1nc(OC)cc(OC)n1)C(N)(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 20/20 0.64
EDNRA P25101 20/20 0.64
NR1I2 O75469 1/20 0.45
KCNE1 P15382 1/20 0.45
KCNQ1 P51787 1/20 0.45

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
SCHEMBL8703985 0.89 EDNRB (0.62) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL6712034 0.87 EDNRB (0.61) EDNRBEDNRA
SCHEMBL6781616 0.86 EDNRB (0.65) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL2350734 0.85 EDNRB (0.81) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL1068402 0.85 EDNRB (0.81) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL8704342 0.82 EDNRB (0.60) EDNRBEDNRA
SCHEMBL8701757 0.81 EDNRB (0.59) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL8706689 0.81 EDNRB (0.59) EDNRBEDNRANR1I2KCNE1KCNQ1
SCHEMBL8109657 0.81 EDNRB (0.84) EDNRBEDNRA
SCHEMBL8200442 0.78 EDNRB (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040034076-A1 Novel carbamates and carbamides, production and use thereof as endothelin receptor antagonists ABBOTT GMBH & CO. KG (DE) 2004-02-19 US disclosed
EP-1286973-A2 NOVEL CARBAMATES AND CARBAMIDES, PRODUCTION AND USE THEREOF AS ENDOTHELIN RECEPTOR ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 2003-03-05 EP disclosed
WO-2001090079-A2 NOVEL CARBAMATES AND CARBAMIDES, PRODUCTION AND USE THEREOF AS ENDOTHELIN RECEPTOR ANTAGONISTS BASF AG (DE) 2001-11-29 WO 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-20040034076-A1 Novel carbamates and carbamides, production and use thereof as endothelin receptor antagonists EDNRA, EDNRB, ECE1 EDNRB 2/4885EDNRA 1/4885NR1I2 496/4885

“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.