SCHEMBL7292292

SCHEMBL7292292

NC(=O)N1CCC(S(=O)(=O)c2ccc(-c3ccccc3Cl)cc2)C(O)(C(=O)O)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.45
AKR1C1 Q04828 1/20 0.45
MMP1 P03956 2/20 0.39
MMP13 P45452 2/20 0.39
SCN9A Q15858 1/20 0.38
DPP4 P27487 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
CNR1 P21554 1/20 0.35
SPR P35270 1/20 0.35
ADAMTS4 O75173 1/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
PLG P00747 1/20 0.34
PLAU P00749 1/20 0.34
ST14 Q9Y5Y6 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FFAR2 O15552 1/20 0.34

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
SCHEMBL7201014 0.88 SMN1; SMN2 (0.41) AKR1C3AKR1C1MMP1MMP13SMN1; SMN2
SCHEMBL7204213 0.88 MMP13 (0.52) AKR1C3AKR1C1MMP1MMP13SCN9A
SCHEMBL7205673 0.88 MMP1 (0.39) MMP1MMP13DPP4DPP7KDM2B
SCHEMBL7204066 0.86 ALDH1A1 (0.38) MMP1MMP13CNR1ADAMTS4ALDH1A1
SCHEMBL7204539 0.86 MMP1 (0.40) MMP1MMP13DPP4DPP7KDM2B
SCHEMBL7199700 0.83 MMP1 (0.42) MMP1MMP13ADAMTS4SMN1; SMN2ALDH1A1
SCHEMBL7290273 0.83 MGLL (0.41) AKR1C3AKR1C1MMP1MMP13KDM2B
SCHEMBL7201540 0.82 ADAMTS4 (0.39) MMP1MMP13DPP4ADAMTS4
SCHEMBL7300738 0.82 MMP13 (0.48) MMP1MMP13RAB9ANPC1ALDH1A1
SCHEMBL7202625 0.82 CCR6 (0.39) MMP1MMP13DPP4DPP7KDM2B

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-1138680-A1 Gem substituted sulfonyl hydroxamic acids as MMP inhibitors Pfizer Products Inc. (US) 2001-10-04 EP disclosed