Sugi Predict

Sugi Predict / Compounds / SCHEMBL4780973

SCHEMBL4780973

SCHEMBL4780973

N#Cc1cccc2c1c(S(=O)(=O)NCCN1CCCCC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 6/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HTR6 P50406 7/20 0.40
▸ SFRP1 Q8N474 1/20 0.40
▸ CNR2 P34972 1/20 0.39
▸ PARP1 P09874 2/20 0.38
▸ HTR7 P34969 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL4783164 0.91 TSHR (0.42) TSHRHTR6CNR2L3MBTL1
SCHEMBL4782487 0.85 HTR6 (0.48) SIGMAR1ALOX15TSHRHTR6SFRP1
SCHEMBL14209100 0.85 SIGMAR1 (0.43) SIGMAR1ALOX15TSHRHTR6SFRP1
SCHEMBL4785354 0.82 MAPK1 (0.41) HTR6
SCHEMBL4783597 0.79 TDP1 (0.51) TSHRHTR6L3MBTL1
SCHEMBL4784058 0.79 HTR6 (0.41) TSHRHTR6
SCHEMBL4783077 0.77 TBXAS1 (0.46) —
SCHEMBL14208706 0.76 TSHR (0.44) TSHRHTR6
SCHEMBL4781382 0.75 HTR6 (0.43) TSHRHTR6
SCHEMBL4783123 0.75 HTR6 (0.45) TSHRHTR6

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-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