SCHEMBL7400418

SCHEMBL7400418

C=CCC(NS(=O)(=O)c1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.55
MMP9 P14780 10/20 0.55
ADAMTS4 O75173 2/20 0.55
MMP13 P45452 4/20 0.54
MMP8 P22894 1/20 0.54
MMP1 P03956 1/20 0.52
MMP3 P08254 1/20 0.52
MMP7 P09237 1/20 0.52
ADAMTS5 Q9UNA0 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
SLC1A3 P43003 2/20 0.49
SLC1A2 P43004 2/20 0.49
SLC1A1 P43005 2/20 0.49

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
SCHEMBL7400420 1.00 MMP2 (0.55) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL3625854 0.87 TDP1 (0.59) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL8072662 0.87 SLC1A3 (0.54) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL5680766 0.86 MMP2 (0.56) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL3623902 0.84 SLC1A3 (0.54) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL18554330 0.83 SLC1A3 (0.55) MMP2MMP9ADAMTS4MMP13MMP8
SCHEMBL13570524 0.83 MMP2 (0.58) MMP2MMP9MMP13MMP8MMP1
SCHEMBL13570713 0.83 MMP2 (0.58) MMP2MMP9MMP13MMP8MMP1
SCHEMBL13570700 0.83 MMP2 (0.58) MMP2MMP9MMP13MMP8MMP1
SCHEMBL3622836 0.83 SLC1A3 (0.55) MMP2MMP9ADAMTS4MMP13MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5648368-A ANTICOAGULANTS MERCK & CO., INC. (US) 1997-07-15 US disclosed
EP-0330239-B1 Photosensitive composition FUJI PHOTO FILM CO LTD (JP) 1996-05-22 EP disclosed
EP-0673247-A4 FIBRINOGEN RECEPTOR ANTAGONISTS. MERCK & CO INC (US) 1996-05-01 EP disclosed
EP-0673247-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1995-09-27 EP disclosed
WO-1994012181-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-06-09 WO disclosed
US-5141838-A Lithography printing plates FUJI PHOTO FILM CO., LTD. (JP) 1992-08-25 US disclosed
EP-0330239-A2 Photosensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1989-08-30 EP disclosed