SCHEMBL4620675

SCHEMBL4620675

COc1cccc(S(=O)(=O)N[C@@H](C)C(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.55
MEP1B Q16820 1/20 0.54
ITGAV P06756 1/20 0.54
PGR P06401 2/20 0.52
FFAR4 Q5NUL3 1/20 0.51
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
KAT6A Q92794 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MMP2 P08253 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
FLT1 P17948 1/20 0.49
FLT4 P35916 1/20 0.49
KDR P35968 1/20 0.49
MMP9 P14780 3/20 0.49
MMP1 P03956 2/20 0.49
MMP3 P08254 2/20 0.49
MMP7 P09237 2/20 0.49
MMP13 P45452 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
SCHEMBL4619809 1.00 ADAMTS4 (0.55) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL4620884 1.00 ADAMTS4 (0.55) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL12376754 0.83 KEAP1 (0.57) MEP1BPGRFFAR4KEAP1NFE2L2
SCHEMBL4313196 0.82 MEP1B (0.51) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL6774257 0.82 MEP1B (0.57) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL4621800 0.82 ITGAV (0.62) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL4620040 0.82 ITGAV (0.62) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL4621094 0.82 ITGAV (0.62) ADAMTS4MEP1BITGAVPGRFFAR4
SCHEMBL4621342 0.82 MMP2 (0.68) ADAMTS4SMN1; SMN2HSD17B10MMP2L3MBTL1
SCHEMBL4618694 0.82 MMP2 (0.68) ADAMTS4SMN1; SMN2HSD17B10MMP2L3MBTL1

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-1884230-A1 PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN Shiseido Company, Limited (JP) 2008-02-06 EP disclosed