SCHEMBL5503986

SCHEMBL5503986

O=S(=O)(NC[C@H](CCO)c1ccco1)c1ccc(Br)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.56
▸ LMNA P02545 3/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ GFER P55789 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ HTT P42858 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ MMP1 P03956 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ MMP3 P08254 1/20 0.40
▸ MMP7 P09237 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ MMP13 P45452 1/20 0.40

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
SCHEMBL5508754 0.93 TP53 (0.54) TP53LMNANPSR1ALDH1A1MAPT
SCHEMBL5504602 0.81 MMP1 (0.49) LMNANPSR1MAPTKMT2ACYP19A1
SCHEMBL3188111 0.70 TP53 (0.45) TP53ALDH1A1MAPTKMT2AGAA
SCHEMBL12949528 0.70 GBA1 (0.58) TP53LMNANPSR1ALDH1A1MAPT
SCHEMBL21225933 0.69 MMP2 (0.50) TP53ALDH1A1CYP19A1GAAMMP1
SCHEMBL3203039 0.68 TP53 (0.43) TP53NPSR1ALDH1A1KMT2AGAA
SCHEMBL1348420 0.68 ALDH1A1 (0.64) ALDH1A1L3MBTL1KMT2ACYP19A1GAA
SCHEMBL5508771 0.68 MAPT (0.59) TP53LMNANPSR1ALDH1A1MAPT
SCHEMBL5502574 0.68 MAPT (0.59) TP53LMNANPSR1ALDH1A1MAPT
SCHEMBL3412348 0.68 CA1 (0.52) ALDH1A1CYP19A1GAAMMP1MMP2

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
EP-1549306-A4 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2007-06-06 — — EP claimed
EP-1549306-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2005-07-06 — — EP claimed
WO-2003103660-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2003-12-18 — — WO claimed
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