SCHEMBL7018853

SCHEMBL7018853

CC(=O)CCS(=O)(=O)N1CCC(Oc2ccc(Cl)cn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.56
FPR2 P25090 2/20 0.54
PROKR1 Q8TCW9 2/20 0.54
LIPE Q05469 2/20 0.42
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDO2 P48775 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
IP6K1 Q92551 1/20 0.39
NAMPT P43490 2/20 0.38
TSHR P16473 1/20 0.38
CACNB4 O00305 1/20 0.38
CACNA1A O00555 1/20 0.38
CACNA1G O43497 1/20 0.38
CACNG3 O60359 1/20 0.38
CACNA1F O60840 1/20 0.38

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
SCHEMBL7018466 0.94 MMP1 (0.54) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL940600 0.89 MMP1 (0.57) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL7023309 0.83 MMP1 (0.57) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL941398 0.83 MMP1 (0.54) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL943749 0.83 MMP1 (0.56) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL942540 0.80 MMP1 (0.58) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL941502 0.80 FPR2 (0.64) MMP1FPR2PROKR1L3MBTL1TDO2
SCHEMBL7014611 0.80 MMP1 (0.51) MMP1FPR2PROKR1LIPETDO2
SCHEMBL940684 0.79 MMP1 (0.52) MMP1FPR2PROKR1LIPEMAPT
SCHEMBL941419 0.79 MMP1 (0.49) MMP1FPR2PROKR1LIPEMAPT

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-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
EP-1370556-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074767-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed