SCHEMBL6821079

SCHEMBL6821079

CN1CCC(Oc2cc(NS(=O)(=O)c3ccc(Sc4ccc(C(F)(F)F)cc4)cc3)ccc2C(F)(F)F)C1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 16/20 0.64
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTR6 P50406 2/20 0.43
MEN1 O00255 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 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
SCHEMBL6821074 1.00 UTS2R (0.64) UTS2RKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL8342132 0.94 UTS2R (0.68) UTS2RHTR6MEN1ALOX15MAPK1
SCHEMBL6824514 0.93 UTS2R (0.64) UTS2RALDH1A1MAPK1
SCHEMBL6824508 0.93 UTS2R (0.64) UTS2RALDH1A1MAPK1
SCHEMBL6824007 0.92 UTS2R (0.60) UTS2RKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6824000 0.92 UTS2R (0.60) UTS2RKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6821124 0.91 UTS2R (0.61) UTS2RHTR6
SCHEMBL8339703 0.91 UTS2R (0.61) UTS2RMEN1KMT2A
SCHEMBL6821133 0.91 UTS2R (0.61) UTS2RHTR6
SCHEMBL6820339 0.90 UTS2R (0.57) UTS2RKDM4EALDH1A1MAPTSMN1; SMN2

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
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO claimed
WO-2004043917-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed