SCHEMBL8562741

SCHEMBL8562741

C=CC(O)C(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(Cc2[nH]ccc3nc(C)nc2-3)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.35
MMP1 P03956 1/20 0.35
MMP3 P08254 1/20 0.35
MMP7 P09237 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP2C9 P11712 1/20 0.35
AIMP2 Q13155 1/20 0.33
KDM4E B2RXH2 2/20 0.33
PLAU P00749 1/20 0.33
HPN P05981 1/20 0.33
CTSL P07711 3/20 0.32
CTSS P25774 3/20 0.32
CTSK P43235 3/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.30

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
SCHEMBL8571410 1.00 MMP2 (0.35) MMP2MMP1MMP3MMP7MMP9
SCHEMBL8565588 0.86 MMP2 (0.34) MMP2MMP1MMP3MMP7MMP9
SCHEMBL8565202 0.86 MMP2 (0.34) MMP2MMP1MMP3MMP7MMP9
SCHEMBL8564128 0.83 MMP2 (0.36) MMP2MMP1MMP3MMP7MMP9
SCHEMBL8569517 0.83 PTAFR (0.35) PLAU
SCHEMBL8570622 0.83 PTAFR (0.35) PLAU
SCHEMBL8569363 0.81 CA1 (0.39) MMP2MMP1MMP3MMP7MMP9
SCHEMBL8568591 0.72 PTAFR (0.41) PLAUALDH1A1
SCHEMBL8563029 0.72 PTAFR (0.41) PLAUALDH1A1
SCHEMBL8569673 0.72 PTAFR (0.38) MMP2MMP9MMP13PLAUALDH1A1

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
EP-0605434-B1 IMIDAZO (4,5-C) PYRIDINE DERIVATIVES AS PAF ANTAGONISTS BRITISH BIOTECH PHARM (GB) 1998-08-19 EP claimed