SCHEMBL2489880

SCHEMBL2489880

COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1OCCOCCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 19/20 0.56
EDNRB P24530 14/20 0.56

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
SCHEMBL3828250 0.93 EDNRA (0.63) EDNRAEDNRB
SCHEMBL2487362 0.91 EDNRA (0.52) EDNRAEDNRB
SCHEMBL8007885 0.86 EDNRA (0.55) EDNRAEDNRB
SCHEMBL2487364 0.84 EDNRA (0.59) EDNRAEDNRB
SCHEMBL7787027 0.84 EDNRA (0.53) EDNRAEDNRB
SCHEMBL1008387 0.83 EDNRA (0.53) EDNRAEDNRB
SCHEMBL7793953 0.83 EDNRA (0.64) EDNRAEDNRB
SCHEMBL2489314 0.83 EDNRA (0.53) EDNRAEDNRB
SCHEMBL1009078 0.83 EDNRA (0.66) EDNRAEDNRB
SCHEMBL1009939 0.81 EDNRA (0.54) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2072503-B1 Process for the preparation of bosentan DIPHARMA FRANCIS SRL (IT) 2011-10-26 EP claimed
EP-2072503-A2 Process for the preparation of bosentan Dipharma Francis S.r.l. (IT) 2009-06-24 EP claimed
US-20090156811-A1 Process for the Preparation of Bosentan DIPHARMA FRANCIS S.R.L. (IT) 2009-06-18 US claimed
EP-2072503-B1 Process for the preparation of bosentan DIPHARMA FRANCIS SRL (IT) 2011-10-26 EP disclosed
EP-2072503-A2 Process for the preparation of bosentan Dipharma Francis S.r.l. (IT) 2009-06-24 EP disclosed
US-20090156811-A1 Process for the Preparation of Bosentan DIPHARMA FRANCIS S.R.L. (IT) 2009-06-18 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-20090156811-A1 Process for the Preparation of Bosentan PAH, HBB, HBZ EDNRA 32/4885EDNRB 8/4885

“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.