SCHEMBL7045164

SCHEMBL7045164

CCOC(=O)CCCOc1ccc(I)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.54
CYSLTR2 Q9NS75 1/20 0.54
CYSLTR1 Q9Y271 1/20 0.54
LTA4H P09960 6/20 0.52
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
FAAH O00519 1/20 0.50
PDK2 Q15119 1/20 0.48
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
P2RY12 Q9H244 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL8326306 0.95 LTA4H (0.53) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL3170654 0.94 LTA4H (0.52) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL17266636 0.93 MAPT (0.52) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL6937314 0.87 MEN1 (0.62) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL8981963 0.85 BRD4 (0.56) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL3466988 0.85 CYSLTR2 (0.59) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL2653015 0.84 LTA4H (0.56) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL3267566 0.84 BRD4 (0.54) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL12549253 0.84 LTA4H (0.59) BRD4CYSLTR2CYSLTR1LTA4HMAPT
SCHEMBL1623579 0.84 BRD4 (0.54) BRD4CYSLTR2CYSLTR1LTA4HMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004063169-A1 HYDROXAMID ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-07-29 WO disclosed
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed