SCHEMBL6825188

SCHEMBL6825188

C[C@@]1(Oc2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2C(F)(F)F)CCNC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ FFAR4 Q5NUL3 8/20 0.39
▸ FFAR1 O14842 3/20 0.39
▸ KIT P10721 1/20 0.38
▸ HSD17B1 P14061 2/20 0.38
▸ HSD17B2 P37059 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MLNR O43193 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ PLA2G7 Q13093 1/20 0.35
▸ CYP17A1 P05093 1/20 0.35
▸ UTS2R Q9UKP6 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
SCHEMBL6821207 0.87 ALDH1A1 (0.39) FFAR4FFAR1ALDH1A1LMNAUTS2R
SCHEMBL6821517 0.87 FFAR4 (0.36) FFAR4FFAR1KITALDH1A1LMNA
SCHEMBL6821531 0.86 FFAR4 (0.38) FFAR4FFAR1KITMLNRMAPT
SCHEMBL6817431 0.85 FFAR4 (0.51) KDM4EFFAR4FFAR1ALDH1A1LMNA
SCHEMBL6820878 0.84 FFAR4 (0.52) FFAR4FFAR1MAPTUTS2R
SCHEMBL6819746 0.84 FFAR4 (0.40) FFAR4FFAR1ALDH1A1LMNAMAPK1
SCHEMBL6819870 0.84 FFAR4 (0.38) FFAR4FFAR1HSD17B1HSD17B2ALDH1A1
SCHEMBL6816212 0.83 FFAR4 (0.53) KDM4EFFAR4FFAR1ALDH1A1LMNA
SCHEMBL6821259 0.83 PLA2G7 (0.41) FFAR4FFAR1ALDH1A1LMNAMAPT
SCHEMBL6822143 0.82 FFAR4 (0.40) FFAR4KITLMNAMAPK1PLA2G7

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-2004043948-A1 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 — — WO disclosed
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