SCHEMBL6557849

SCHEMBL6557849

Nc1ccc(S(=O)(=O)N2CCCCC(=O)C2)cc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.53
MMP2 P08253 1/20 0.50
AKR1C3 P42330 1/20 0.49
LMNA P02545 1/20 0.49
PKM P14618 3/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 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
SCHEMBL6559970 0.89 KMT2A (0.56) USP2MMP2AKR1C3PKMALDH1A1
SCHEMBL17369299 0.84 PKM (0.64) USP2MMP2LMNAPKMPOLB
SCHEMBL655768 0.83 USP2 (0.76) USP2LMNAPKMPOLBALDH1A1
SCHEMBL3690418 0.81 USP2 (0.80) USP2AKR1C3LMNAPKMPOLB
SCHEMBL165129 0.81 USP2 (0.80) USP2AKR1C3LMNAPKMPOLB
SCHEMBL78283 0.79 USP2 (0.69) USP2MMP2PKMPOLBALDH1A1
SCHEMBL12169347 0.79 PKM (0.65) USP2MMP2LMNAPKMPOLB
SCHEMBL19348414 0.79 MEN1 (0.57) USP2MMP2AKR1C3PKMPOLB
SCHEMBL14132273 0.79 MCOLN3 (0.55) USP2AKR1C3LMNAPKMPOLB
SCHEMBL11306227 0.75 PKM (0.69) USP2MMP2PKMPOLBALDH1A1

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
EP-1436255-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS Aventis Pharmaceuticals, Inc. (US) 2004-07-14 EP disclosed
WO-2003024924-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2003-03-27 WO disclosed