SCHEMBL7220248

SCHEMBL7220248

COC(=O)[C@@H]1CCN(S(=O)(=O)CCCOc2ccc(F)cc2)[C@@H](C(=O)O)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 4/20 0.55
MMP1 P03956 3/20 0.55
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
LTA4H P09960 3/20 0.41
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP10 P09238 1/20 0.40
MMP8 P22894 1/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PTGER4 P35408 2/20 0.40
KDM4E B2RXH2 1/20 0.39
HTT P42858 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
SCHEMBL7220732 0.90 MMP1 (0.68) ADAM17MMP1MMP2MMP3MMP8
SCHEMBL8521305 0.90 MMP1 (0.68) ADAM17MMP1MMP2MMP3MMP8
SCHEMBL7215199 0.89 ADAM17 (0.52) ADAM17MMP1NPC1RAB9ALTA4H
SCHEMBL7221238 0.85 ADAM17 (0.57) ADAM17MMP1NPC1RAB9ALTA4H
SCHEMBL8521079 0.84 MMP1 (0.55) ADAM17MMP1MMP2MMP3MMP8
SCHEMBL7214373 0.84 MMP1 (0.55) ADAM17MMP1MMP2MMP3MMP8
SCHEMBL7216567 0.73 MMP1 (0.80) ADAM17MMP1MMP2MMP3MMP8
SCHEMBL7221296 0.71 MMP1 (1.00) ADAM17MMP1MMP3MMP8MMP13
SCHEMBL7220119 0.71 MMP1 (1.00) ADAM17MMP1MMP3MMP8MMP13
SCHEMBL8216398 0.69 MMP1 (0.64) ADAM17MMP1MMP2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6599890-B1 Inhibitors of matrix metalloproteinases or the production of tumor necrosis factor PFIZER INC 2003-07-29 US disclosed
EP-0960098-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-12-01 EP disclosed
WO-1998034918-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-08-13 WO disclosed