SCHEMBL7870903

SCHEMBL7870903

Cc1ccc(C#Cc2ccc(S(=O)(=O)CC(Cc3ccccc3)C(=O)O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.51
MMP9 P14780 7/20 0.51
MMP3 P08254 3/20 0.49
MMP13 P45452 2/20 0.49
CYP1A2 P05177 1/20 0.46
MMP1 P03956 1/20 0.46
MMP8 P22894 1/20 0.46
FFAR1 O14842 2/20 0.46
ACACB O00763 1/20 0.46
MMP12 P39900 1/20 0.45
KMT2A Q03164 1/20 0.45
GAA P10253 1/20 0.44
RECQL P46063 1/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
MCHR1 Q99705 1/20 0.43

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
SCHEMBL7874054 0.85 LMNA (0.43) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7327841 0.82 CYP1A2 (0.63) MMP2MMP9MMP3CYP1A2MMP1
SCHEMBL7349315 0.82 CYP1A2 (0.63) MMP2MMP9MMP3CYP1A2MMP1
SCHEMBL8909236 0.82 CYP1A2 (0.63) MMP2MMP9MMP3CYP1A2MMP1
SCHEMBL6378071 0.79 ALDH1A1 (0.53) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7867129 0.79 MMP9 (0.52) MMP2MMP9MMP3MMP13FFAR1
SCHEMBL7868862 0.79 MMP9 (0.52) MMP2MMP9MMP3MMP13FFAR1
SCHEMBL7862162 0.79 MMP9 (0.56) MMP2MMP9MMP3MMP13FFAR1
SCHEMBL7080740 0.78 MMP1 (0.55) MMP2MMP9MMP3MMP13CYP1A2
SCHEMBL7076041 0.78 MMP2 (0.72) MMP2MMP9MMP3CYP1A2MMP1

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
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US claimed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP claimed
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US disclosed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP disclosed