SCHEMBL6596228

SCHEMBL6596228

CC(C)C[C@H](NC(=O)Oc1cc2ccccc2s1)C(=O)N[C@H]1CCN(Cc2ccc(OCCCN(C)C)c(Br)c2)C1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 20/20 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
SCHEMBL6596760 0.91 UTS2R (0.68) UTS2R
SCHEMBL6595561 0.90 UTS2R (0.82) UTS2R
SCHEMBL6600179 0.86 UTS2R (0.70) UTS2R
SCHEMBL6597367 0.86 UTS2R (0.72) UTS2R
SCHEMBL6599225 0.85 UTS2R (0.83) UTS2R
SCHEMBL6598768 0.84 UTS2R (0.77) UTS2R
SCHEMBL6596429 0.81 UTS2R (0.65) UTS2R
SCHEMBL6599748 0.80 UTS2R (0.62) UTS2R
SCHEMBL6622876 0.77 UTS2R (0.81) UTS2R
SCHEMBL6595279 0.75 UTS2R (0.85) UTS2R

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
EP-1246619-B1 UROTENSIN-II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-20 EP claimed