SCHEMBL5506459

SCHEMBL5506459

Cc1ccc(C2CCN(S(=O)(=O)CC(O)C#Cc3ccccc3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.43
USP5 P45974 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HSD17B2 P37059 1/20 0.39
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
PKM P14618 2/20 0.37
CCR5 P51681 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SLC18A3 Q16572 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
SCHEMBL2155207 0.86 MMP3 (0.46) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL27713628 0.85 MMP3 (0.43) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2154896 0.84 MMP3 (0.48) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2154893 0.83 MMP3 (0.39) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL5509222 0.80 MMP3 (0.50) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2156697 0.76 MMP3 (0.44) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2154948 0.76 MMP3 (0.46) MMP3USP5ALDH1A1SMN1; SMN2HSD17B2
SCHEMBL2155627 0.76 MMP3 (0.48) MMP3USP5ALDH1A1NPC1RAB9A
SCHEMBL16493552 0.75 MMP3 (0.46) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL16994786 0.74 LMNA (0.56) MMP3USP5KDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828160-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-09-05 EP claimed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 WO claimed
EP-1828160-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-09-05 EP disclosed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 WO disclosed