Sugi Predict

Sugi Predict / Compounds / SCHEMBL4733669

SCHEMBL4733669

SCHEMBL4733669

O=C(O)Nc1cccc(C(=O)N2CCC(NS(=O)(=O)c3ccc(-c4ccccc4)cc3C(F)(F)F)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SFRP1 Q8N474 17/20 0.56
▸ WNT3 P56703 2/20 0.46
▸ CCR8 P51685 1/20 0.46
▸ MGLL Q99685 1/20 0.45
▸ ADAMTS7 Q9UKP4 1/20 0.44
▸ ADAMTS5 Q9UNA0 1/20 0.44

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
SCHEMBL4736342 0.91 SFRP1 (0.57) SFRP1WNT3CCR8
SCHEMBL4781291 0.91 SFRP1 (0.52) SFRP1WNT3ADAMTS7ADAMTS5
SCHEMBL4734910 0.89 SFRP1 (0.54) SFRP1WNT3CCR8
SCHEMBL4734370 0.88 SFRP1 (0.57) SFRP1WNT3ADAMTS7ADAMTS5
SCHEMBL4734816 0.85 SFRP1 (0.59) SFRP1WNT3CCR8
SCHEMBL4785270 0.85 SFRP1 (0.60) SFRP1WNT3
SCHEMBL4735053 0.84 SFRP1 (0.57) SFRP1WNT3
SCHEMBL4733324 0.84 SFRP1 (0.53) SFRP1WNT3CCR8
SCHEMBL4735911 0.83 SFRP1 (0.54) SFRP1WNT3
SCHEMBL4735525 0.83 SFRP1 (0.61) SFRP1WNT3

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