SCHEMBL27622286

SCHEMBL27622286

CCC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccc(Br)cc12

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 1/20 0.57
▸ AKR1C1 Q04828 1/20 0.57
▸ LMNA P02545 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ PLK1 P53350 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TNF P01375 3/20 0.47
▸ HTR6 P50406 10/20 0.45
▸ TNFSF11 O14788 2/20 0.44
▸ HTR2A P28223 1/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 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
SCHEMBL946621 0.86 LMNA (0.71) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL27622290 0.85 LMNA (0.72) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL20424529 0.79 AKR1C3 (0.64) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL950467 0.78 AKR1C3 (0.50) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL950466 0.78 AKR1C3 (0.50) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL21274665 0.78 AKR1C3 (0.56) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL946389 0.78 HTR6 (0.56) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL19194701 0.77 LMNA (0.71) AKR1C3AKR1C1LMNASMN1; SMN2PLK1
SCHEMBL3029070 0.76 PPARG (0.62) AKR1C3AKR1C1HTR6HTR7
SCHEMBL1466474 0.76 AKR1C3 (0.60) AKR1C3AKR1C1LMNASMN1; SMN2PLK1

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
CN-1720225-B N-arylsulfonyl-3-substituted indoles having 5-hydroxytryptamine receptor affinity, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LTD 2011-05-18 — — CN disclosed
CN-101544592-A N-arylsulfonyl-3-substituted indoles having serotonin receptor affinity, process for their preparation and pharmaceutical composition containing them SUVEN LIFE SCIENCES LTD (IN) 2009-09-30 — — CN disclosed
CN-1720225-A N-arylsulfonyl-3-substituted indoles having 5-hydroxytryptamine receptor affinity, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LTD (IN) 2006-01-11 — — CN disclosed
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