SCHEMBL4783673

SCHEMBL4783673

CCOC(=O)N1CCC(NS(=O)(=O)c2cn(S(=O)(=O)c3ccccc3)c3cccc(C(C)C)c23)CC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 13/20 0.51
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 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
SCHEMBL14208234 0.90 HTR6 (0.49) CCR8ALDH1A1
SCHEMBL4784223 0.90 HTR1A (0.42) CCR8
SCHEMBL4785454 0.88 CCR8 (0.51) CCR8ALDH1A1SMN1; SMN2LMNAUSP2
SCHEMBL4782745 0.86 SFRP1 (0.52) CCR8
SCHEMBL4802468 0.85 HTR1A (0.46)
SCHEMBL4781850 0.85 SFRP1 (0.44) CCR8
SCHEMBL14207899 0.83 HTR6 (0.43) ALDH1A1SMN1; SMN2LMNA
SCHEMBL4782531 0.82 SFRP1 (0.53) ALDH1A1
SCHEMBL4784467 0.82 HTR6 (0.42) SMN1; SMN2LMNA
SCHEMBL4782045 0.81 HTR6 (0.45) CCR8ALDH1A1

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-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed