SCHEMBL6677066

SCHEMBL6677066

C[C@@]1(Oc2cc(NS(=O)(=O)c3ccc4c(Cl)cccc4c3)ccc2C(F)(F)F)CCNC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 5/20 0.46
▸ HTR1A P08908 1/20 0.44
▸ HTR1D P28221 1/20 0.44
▸ HTR1B P28222 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ HTR7 P34969 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ GHSR Q92847 1/20 0.39
▸ MAPT P10636 2/20 0.37
▸ SCN9A Q15858 9/20 0.37
▸ SCN5A Q14524 3/20 0.37
▸ BRAF P15056 1/20 0.37
▸ FFAR1 O14842 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ PLAU P00749 1/20 0.35
▸ PLAT P00750 1/20 0.35

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
SCHEMBL6677943 0.88 KMT2A (0.45) GHSRMAPTFFAR4PLAUPLAT
SCHEMBL6672598 0.86 HTR6 (0.42) HTR6
SCHEMBL6817411 0.85 BRAF (0.40) HTR6MAPTSCN9ABRAFFFAR1
SCHEMBL6823530 0.84 BRAF (0.38) MAPTBRAFFFAR1FFAR4TP53
SCHEMBL6817421 0.84 PLA2G7 (0.44) —
SCHEMBL6819746 0.83 FFAR4 (0.40) MAPTFFAR1FFAR4TP53
SCHEMBL6819870 0.83 FFAR4 (0.38) HTR6MAPTFFAR1FFAR4TP53
SCHEMBL6820791 0.83 FFAR4 (0.36) MAPTBRAFFFAR1FFAR4TP53
SCHEMBL6817431 0.82 FFAR4 (0.51) GHSRMAPTFFAR1FFAR4TP53
SCHEMBL6820305 0.82 FFAR4 (0.38) MAPTFFAR1FFAR4TP53

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-2004043369-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 — — WO claimed
Send feedback