SCHEMBL7419487

SCHEMBL7419487

CCC(C(=O)OC(C)(C)C)C(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.52
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.45
CTSB P07858 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LTA4H P09960 1/20 0.41
PPARA Q07869 1/20 0.41
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL7419491 1.00 SYK (0.52) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL4633702 0.86 CTSK (0.47) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL7418023 0.86 CTSK (0.47) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL5497072 0.86 CTSK (0.47) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL5187344 0.83 CTSK (0.47) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL7370167 0.83 SYK (0.44) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL5188450 0.83 CTSK (0.47) SYKALDH1A1POLBCTSBMAPK1
SCHEMBL28014675 0.83 SYK (0.47) SYKALDH1A1POLBMAPK1L3MBTL1
SCHEMBL7420417 0.82 L3MBTL1 (0.47) SYKALDH1A1POLBMAPK1L3MBTL1
SCHEMBL7369332 0.82 POLB (0.49) SYKALDH1A1POLBCTSBMAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5594006-A SUCH AS COLLEGENASE, STROMELYSIN; ANTICANCER AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
EP-0641323-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-03-08 EP disclosed
WO-1994021612-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-29 WO disclosed