SCHEMBL7326206

SCHEMBL7326206

COCCc1nc(Cl)c(Oc2cccc(OC)c2)c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)n1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.58
EDNRA P25101 1/20 0.58

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
SCHEMBL7582149 0.86 EDNRB (0.57) EDNRBEDNRA
SCHEMBL7303594 0.85 EDNRA (0.75) EDNRBEDNRA
SCHEMBL9423683 0.85 EDNRA (0.59) EDNRBEDNRA
SCHEMBL7296697 0.83 EDNRA (0.56) EDNRBEDNRA
SCHEMBL7990440 0.81 EDNRB (0.55) EDNRBEDNRA
SCHEMBL7294305 0.81 EDNRB (0.71) EDNRBEDNRA
SCHEMBL9423879 0.81 EDNRA (0.70) EDNRBEDNRA
SCHEMBL7585609 0.80 EDNRB (0.51) EDNRBEDNRA
SCHEMBL7301565 0.80 EDNRB (0.51) EDNRBEDNRA
SCHEMBL9423821 0.80 EDNRA (0.73) 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
EP-0526708-B1 Sulfonamide, preparation and use thereof as medicine and intermediate HOFFMANN LA ROCHE (CH) 2000-10-18 EP disclosed
US-5292740-A Sulfonamides HOFFMANN-LA ROCHE INC. (US) 1994-03-08 US disclosed
EP-0526708-A1 Sulfonamide, preparation and use thereof as medicine and intermediate F. HOFFMANN-LA ROCHE AG (CH) 1993-02-10 EP disclosed