SCHEMBL7302917

SCHEMBL7302917

COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1N(CC(C)C)S(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 19/20 0.51
EDNRB P24530 3/20 0.41
DHPS P49366 1/20 0.41

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
SCHEMBL7293765 0.92 EDNRA (0.44) EDNRADHPS
SCHEMBL7303989 0.90 DHPS (0.47) EDNRAEDNRBDHPS
SCHEMBL8322432 0.88 LMNA (0.41) EDNRADHPS
SCHEMBL7305832 0.87 ALDH1A1 (0.44) EDNRADHPS
SCHEMBL622948 0.86 MEN1 (0.45) EDNRAEDNRBDHPS
SCHEMBL7302684 0.86 DHPS (0.38) EDNRADHPS
SCHEMBL7300166 0.86 DHPS (0.38) EDNRAEDNRBDHPS
SCHEMBL7297143 0.86 DHPS (0.42) EDNRADHPS
SCHEMBL7292782 0.86 EDNRA (0.40) EDNRADHPS
SCHEMBL7305025 0.85 DHPS (0.42) EDNRADHPS

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
EP-0601386-A1 Sulphonamides F. HOFFMANN-LA ROCHE AG (CH) 1994-06-15 EP disclosed
EP-0526708-A1 Sulfonamide, preparation and use thereof as medicine and intermediate F. HOFFMANN-LA ROCHE AG (CH) 1993-02-10 EP disclosed