Sugi Predict

Sugi Predict / Compounds / SCHEMBL6772817

SCHEMBL6772817

SCHEMBL6772817

CC(=O)Nc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(-c2ccc(CC(C)C)cc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EDNRB P24530 1/20 0.68
▸ EDNRA P25101 1/20 0.68

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
SCHEMBL6772824 0.92 EDNRB (0.67) EDNRBEDNRA
SCHEMBL6771570 0.90 EDNRA (0.65) EDNRBEDNRA
SCHEMBL6767145 0.89 EDNRB (0.68) EDNRBEDNRA
SCHEMBL6767611 0.88 EDNRB (0.67) EDNRBEDNRA
SCHEMBL6771940 0.88 EDNRB (0.66) EDNRBEDNRA
SCHEMBL6771913 0.87 EDNRA (0.71) EDNRBEDNRA
SCHEMBL6772795 0.85 EDNRB (0.58) EDNRBEDNRA
SCHEMBL6777719 0.84 EDNRA (0.74) EDNRBEDNRA
SCHEMBL6767779 0.83 EDNRB (0.70) EDNRBEDNRA
SCHEMBL6768276 0.82 EDNRB (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6107320-A Phenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB CO. (US) 2000-08-22 — — US claimed
US-6673824-B1 HYPOTENSIVE AGENTS BRISTOL-MYERS SQUIBB CO. 2004-01-06 — — US disclosed