SCHEMBL7664941

SCHEMBL7664941

COc1ccccc1S(=O)(=O)N1CN(Cc2ccccc2)C(=O)C[C@@H]1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.60
MMP1 P03956 4/20 0.60
MMP3 P08254 4/20 0.60
MMP9 P14780 4/20 0.60
MMP8 P22894 4/20 0.60
MMP7 P09237 2/20 0.49
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
MAPT P10636 2/20 0.42
ALDH1A1 P00352 4/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 1/20 0.40
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL7480352 0.84 MMP2 (0.81) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7480347 0.84 MMP2 (0.81) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7483182 0.76 MMP1 (0.79) MMP2MMP1MMP3MMP9MMP8
SCHEMBL4312415 0.75 MMP1 (1.00) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7479388 0.74 MMP1 (0.75) MMP2MMP1MMP3MMP9MMP8
SCHEMBL5701852 0.74 POLB (0.49) ALDH1A1PKMSMN1; SMN2HCRTR1HCRTR2
SCHEMBL5702166 0.74 POLB (0.49) ALDH1A1PKMSMN1; SMN2HCRTR1HCRTR2
SCHEMBL7428159 0.72 MMP1 (0.80) MMP2MMP1MMP3MMP9MMP8
SCHEMBL2535135 0.67 EHMT2 (0.47) ALDH1A1HCRTR1HCRTR2
SCHEMBL2535132 0.67 EHMT2 (0.47) ALDH1A1HCRTR1HCRTR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6399598-B1 ORAL DISEASES; RHEUMATIC DISEASES; OSTEOPOROSIS THE PROCTER & GAMBLE COMPANY 2002-06-04 US disclosed