SCHEMBL7866972

SCHEMBL7866972

CCCCCC#Cc1ccc(S(=O)(=O)CCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.62
FFAR4 Q5NUL3 1/20 0.62
MMP2 P08253 3/20 0.61
MMP12 P39900 1/20 0.61
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.46
PTPN7 P35236 5/20 0.45
HMGCR P04035 2/20 0.45
MMP1 P03956 1/20 0.45
RECQL P46063 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
BLM P54132 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
SCHEMBL7867121 0.83 FFAR1 (0.46) FFAR1FFAR4MMP2MMP12HTT
SCHEMBL7874162 0.80 MMP2 (0.50) FFAR1FFAR4MMP2MMP12CYSLTR2
SCHEMBL25167615 0.77 FFAR1 (0.85) FFAR1FFAR4MMP2MMP12ALDH1A1
SCHEMBL7862207 0.77 FFAR1 (0.57) FFAR1FFAR4MMP2HTTNPSR1
SCHEMBL7870820 0.74 MMP2 (0.45) FFAR1FFAR4MMP2MMP12MMP1
SCHEMBL6937361 0.74 MMP2 (0.69) FFAR1FFAR4MMP2MMP12ALDH1A1
SCHEMBL7869959 0.74 HTT (0.83) MMP2HTTNPSR1KDM4EALDH1A1
SCHEMBL8446074 0.73 MMP2 (0.64) FFAR1FFAR4MMP2MMP12MMP1
SCHEMBL25456552 0.73 FFAR1 (0.74) FFAR1FFAR4MMP2MMP12ALDH1A1
SCHEMBL30143434 0.73 MMP2 (0.72) FFAR1FFAR4MMP2MMP12ALDH1A1

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