SCHEMBL6089927

SCHEMBL6089927

O=C(O)c1c(-c2ccccc2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1CCCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 18/20 0.66
EDNRB P24530 15/20 0.66

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
SCHEMBL6091187 0.80 SERPINE1 (0.44) EDNRAEDNRB
SCHEMBL5739485 0.79 ACLY (0.53) EDNRAEDNRB
SCHEMBL8902174 0.71 EDNRB (0.76) EDNRAEDNRB
SCHEMBL8900846 0.71 EDNRA (0.81) EDNRAEDNRB
SCHEMBL8856802 0.71 EDNRA (0.61) EDNRAEDNRB
SCHEMBL6092056 0.70 EDNRA (0.47) EDNRAEDNRB
SCHEMBL8857250 0.69 EDNRA (0.62) EDNRAEDNRB
SCHEMBL8902335 0.69 EDNRB (0.80) EDNRAEDNRB
SCHEMBL6090219 0.69 KMT2A (0.54)
SCHEMBL7397513 0.69 HDAC1 (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 EDNRA 155/4885EDNRB 226/4885

“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.