SCHEMBL4778152

SCHEMBL4778152

CC([C]=O)CC(=O)CCCCl

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10581622 0.82 CES1 (0.41)
SCHEMBL3160334 0.77 HDAC3 (0.39)
SCHEMBL11306443 0.72
SCHEMBL1685807 0.69 TSHR (0.40)
SCHEMBL11603989 0.68 CA1 (0.39)
SCHEMBL27835211 0.67
SCHEMBL1267259 0.66
SCHEMBL9731067 0.66
SCHEMBL2951344 0.66
SCHEMBL724425 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1892239-B1 Inhibitors of cytosolic phospholipase A2 WYETH LLC (US) 2013-02-20 EP disclosed
EP-1892239-A1 Inhibitors of cytosolic phospholipase A2 Wyeth a Corporation of the State of Delaware (US) 2008-02-27 EP disclosed
EP-1451154-B1 INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 WYETH CORP (US) 2008-01-16 EP disclosed
EP-1451154-A2 INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 Wyeth (US) 2004-09-01 EP disclosed
US-6635771-B2 Useful as intermediates in the synthesis of compounds having activity as chemical inhibitors of various phospholipase enzymes, particularly phospholipase A2 WYETH 2003-10-21 US disclosed
US-20030158405-A1 Chemical intermediates for making a phospholipase enzyme inhibitors WYETH 2003-08-21 US disclosed
WO-2003048122-A2 INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 WYETH (US) 2003-06-12 WO disclosed