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SCHEMBL6639751

SCHEMBL6639751

Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)C(C)C)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EDNRB P24530 19/20 1.00
▸ EDNRA P25101 18/20 1.00

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
SCHEMBL6639918 0.93 EDNRB (0.86) EDNRBEDNRA
SCHEMBL6645243 0.92 EDNRB (0.88) EDNRBEDNRA
SCHEMBL6644468 0.92 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6641060 0.92 EDNRB (0.85) EDNRBEDNRA
SCHEMBL6644318 0.92 EDNRB (0.87) EDNRBEDNRA
SCHEMBL6639342 0.91 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6637189 0.91 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6639907 0.90 EDNRB (0.84) EDNRBEDNRA
SCHEMBL6642360 0.90 EDNRB (0.82) EDNRBEDNRA
SCHEMBL6639459 0.89 EDNRB (0.91) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0921800-B1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL MYERS SQUIBB CO (US) 2004-04-14 — — EP claimed
EP-0921800-A4 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL MYERS SQUIBB CO (US) 2000-12-06 — — EP claimed
EP-0921800-A1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-16 — — EP claimed
WO-1997029748-A1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL-MYERS SQUIBB COMPANY (US) 1997-08-21 — — WO claimed
EP-0921800-B1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL MYERS SQUIBB CO (US) 2004-04-14 — — EP disclosed