SCHEMBL9624732

SCHEMBL9624732

Cc1cc(=O)c(O)c(CCCCO)o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.44
KDM4E B2RXH2 6/20 0.39
POLB P06746 3/20 0.39
MAPT P10636 3/20 0.39
PTGS1 P23219 3/20 0.39
PTGS2 P35354 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MMP3 P08254 3/20 0.37
DAO P14920 1/20 0.37
BCL2 P10415 1/20 0.36

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
SCHEMBL9625259 0.95 MMP2 (0.45) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL9625193 0.88 MMP2 (0.47) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL8399916 0.87 MMP2 (0.44) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL9625177 0.85 MMP2 (0.45) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL8397201 0.81 MMP2 (0.47) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL2120661 0.80 MMP2 (0.49) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL5315829 0.77 MMP2 (0.49) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL10902995 0.72 BCL2 (0.55) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL13439135 0.72 MMP2 (0.46) MMP2KDM4EPOLBMAPTPTGS1
SCHEMBL9626235 0.71 BCL2 (0.47) MMP2KDM4EPOLBMAPTPTGS1

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
EP-0473764-A1 METAL COMPLEXES Hider, Robert Charles (GB) 1992-03-11 EP claimed
WO-1991014664-A1 METAL COMPLEXES HIDER ROBERT CHARLES (GB) 1991-10-03 WO claimed
EP-0473764-A1 METAL COMPLEXES Hider, Robert Charles (GB) 1992-03-11 EP disclosed
WO-1991014664-A1 METAL COMPLEXES HIDER ROBERT CHARLES (GB) 1991-10-03 WO disclosed