Sugi Predict

Sugi Predict / Compounds / SCHEMBL4784394

SCHEMBL4784394

SCHEMBL4784394

O=S(=O)(NC1CCNC1)c1cn(S(=O)(=O)c2ccccc2)c2cccc(C(F)(F)F)c12

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 11/20 0.50
▸ SFRP1 Q8N474 8/20 0.49
▸ WNT3 P56703 1/20 0.49
▸ HTR2C P28335 1/20 0.43
▸ HDAC4 P56524 1/20 0.39

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
SCHEMBL4782529 0.94 SFRP1 (0.56) HTR6SFRP1WNT3
Hydrochloric Acid SCHEMBL4781661 0.93 SFRP1 (0.55) HTR6SFRP1WNT3
SCHEMBL4780921 0.86 SFRP1 (0.48) HTR6SFRP1WNT3
SCHEMBL4783893 0.85 SFRP1 (0.50) HTR6SFRP1WNT3
SCHEMBL4783391 0.85 SFRP1 (0.46) HTR6SFRP1WNT3
SCHEMBL4784256 0.85 SFRP1 (0.46) HTR6SFRP1WNT3
SCHEMBL4781473 0.85 SFRP1 (0.46) HTR6SFRP1WNT3
SCHEMBL4781306 0.85 SFRP1 (0.46) HTR6SFRP1WNT3
SCHEMBL4783281 0.85 HTR6 (0.47) HTR6SFRP1WNT3
SCHEMBL4783287 0.85 HTR6 (0.47) HTR6SFRP1WNT3

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 3 patents. 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 claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 — — WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 — — WO disclosed