SCHEMBL6824191

SCHEMBL6824191

CN1CC[C@@H](Oc2cc(NS(=O)(=O)c3ccc(C(F)(F)F)c(F)c3)ccc2C(F)(F)F)C1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 17/20 0.67
TP53 P04637 1/20 0.43
ERAP1 Q9NZ08 1/20 0.40

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
SCHEMBL6819749 1.00 UTS2R (0.67) UTS2RTP53ERAP1
SCHEMBL8339345 0.95 UTS2R (0.66) UTS2RTP53
SCHEMBL8339355 0.93 UTS2R (0.70) UTS2RERAP1
SCHEMBL6817433 0.91 UTS2R (0.68) UTS2RTP53
SCHEMBL6814887 0.89 UTS2R (0.66) UTS2RTP53
SCHEMBL5834910 0.89 UTS2R (0.71) UTS2R
SCHEMBL5834906 0.89 UTS2R (0.71) UTS2R
SCHEMBL8342132 0.89 UTS2R (0.68) UTS2R
SCHEMBL8342761 0.89 UTS2R (0.68) UTS2R
SCHEMBL6820879 0.89 UTS2R (0.70) 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
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed