SCHEMBL4732371

SCHEMBL4732371

CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)c2cc(Br)ccc2OC(F)(F)F)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 6/20 0.50
CCR8 P51685 1/20 0.49
STS P08842 2/20 0.48
USP30 Q70CQ3 1/20 0.47
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
BRD4 O60885 1/20 0.46
ALPL P05186 3/20 0.45
LMNA P02545 1/20 0.44
WNT3 P56703 2/20 0.44
ALDH1A1 P00352 1/20 0.43
EPHX2 P34913 1/20 0.43

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
SCHEMBL4735919 0.92 MCHR1 (0.51) SFRP1CCR8STSUSP30KDM4E
SCHEMBL16013308 0.89 STS (0.61) SFRP1CCR8STSUSP30KDM4E
SCHEMBL4732954 0.88 ALPL (0.49) SFRP1CCR8KDM4EHSD17B10ALPL
SCHEMBL4735664 0.84 SFRP1 (0.58) SFRP1CCR8STSUSP30KDM4E
SCHEMBL8009703 0.83 STS (0.56) SFRP1CCR8STSUSP30BRD4
SCHEMBL17394215 0.83 STS (0.53) SFRP1CCR8STSUSP30KDM4E
SCHEMBL16124960 0.80 CCR8 (0.52) SFRP1CCR8STSUSP30KDM4E
SCHEMBL21760965 0.80 MCHR1 (0.51) ALPLLMNA
SCHEMBL21760943 0.80 MCHR1 (0.51) ALPLLMNA
SCHEMBL3413300 0.80 STS (0.57) SFRP1CCR8STSBRD4ALDH1A1

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-2008061016-A1 N-SUBSTITUTED PIPERIDINYL 4 -ARYLSULFONAMIDES AS MODULATORS OF THE SECRETED FRIZZLED RELATED PROTEIN- 1 WYETH (US) 2008-05-22 WO disclosed