SCHEMBL7311423

SCHEMBL7311423

CCN(CC)Cc1c(NC)ccc(C(=O)OC)c1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MMP13 P45452 5/20 0.42
MMP9 P14780 4/20 0.42
MMP1 P03956 3/20 0.42
ADAM17 P78536 2/20 0.42
LMNA P02545 3/20 0.39
MMP12 P39900 4/20 0.39
USP2 O75604 2/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
PKM P14618 2/20 0.38
MMP2 P08253 3/20 0.37
MMP8 P22894 3/20 0.37
MMP14 P50281 3/20 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
SCHEMBL7316366 0.92 MMP13 (0.42) MMP13MMP9MMP1ADAM17MMP12
SCHEMBL7315181 0.87 LMNA (0.42) KDM4EHSD17B10MMP13MMP9MMP1
SCHEMBL7311630 0.79 LMNA (0.51) KDM4EHSD17B10MMP13MMP9MMP1
SCHEMBL7323234 0.78 MMP1 (0.44) KDM4EMMP13MMP9MMP1ADAM17
SCHEMBL7322302 0.70 MMP9 (0.42) KDM4EMMP13MMP9MMP1ADAM17
SCHEMBL7316231 0.69 MMP1 (0.44) KDM4EMMP13MMP9MMP1ADAM17
SCHEMBL7316400 0.68 MMP9 (0.54) MMP13MMP9MMP1ADAM17MMP12
SCHEMBL7317524 0.67 NAMPT (0.53) MMP13MMP9MMP1ADAM17ALDH1A1
SCHEMBL7311421 0.67 MMP1 (0.81) KDM4EHSD17B10MMP13MMP9MMP1
SCHEMBL7322461 0.66 LMNA (0.37) KDM4EHSD17B10MMP13MMP9MMP1

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
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed