SCHEMBL4263079

SCHEMBL4263079

CC(O)C(=O)OCC(=O)OC(C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL9313924 0.81 LMNA (0.41) TP53MAPT
SCHEMBL16359872 0.79 MMP1 (0.31) MMP1MMP2MMP3MMP9MMP13
SCHEMBL13624500 0.79 MMP1 (0.38) TP53MMP1MMP2MMP3MMP9
SCHEMBL44463 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL21768461 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL23673200 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL8557040 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL18651139 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL12046593 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9
SCHEMBL29743149 0.78 TP53 (0.50) TP53MMP1MMP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956644-B2 Transdermal delivery systems DURECT CORPORATION (US) 2015-02-17 US claimed
US-20130317456-A1 Transdermal Delivery Systems DURECT CORPORATION (US) 2013-11-28 US claimed
US-20130273139-A1 TRANSDERMAL DELIVERY SYSTEMS DURECT CORPORATION 2013-10-17 US claimed
EP-2484347-A1 Transdermal delivery systems comprising bupivacaine Durect Corporation (US) 2012-08-08 EP claimed
EP-2117521-B1 TRANSDERMAL DELIVERY SYSTEMS COMPRISING BUPIVACAINE DURECT CORP (US) 2012-06-27 EP claimed
US-20090060986-A1 Transdermal delivery systems DURECT CORPORATION 2009-03-05 US claimed
WO-2008066642-A2 TRANSDERMAL DELIVERY SYSTEMS COMPRISING BUPIVACAINE DURECT CORPORATION (US) 2008-06-05 WO claimed
US-20180110739-A1 Transdermal Delivery Systems DURECT CORPORATION (US) 2018-04-26 US disclosed
US-20170007549-A1 Transdermal Delivery Systems DURECT CORPORATION 2017-01-12 US disclosed
US-8956644-B2 Transdermal delivery systems DURECT CORPORATION (US) 2015-02-17 US disclosed
US-20130317456-A1 Transdermal Delivery Systems DURECT CORPORATION (US) 2013-11-28 US disclosed
US-20130273139-A1 TRANSDERMAL DELIVERY SYSTEMS DURECT CORPORATION 2013-10-17 US disclosed
US-8337883-B2 Transdermal delivery systems DURECT CORPORATION (US) 2012-12-25 US disclosed
EP-2484347-A1 Transdermal delivery systems comprising bupivacaine Durect Corporation (US) 2012-08-08 EP disclosed
EP-2117521-B1 TRANSDERMAL DELIVERY SYSTEMS COMPRISING BUPIVACAINE DURECT CORP (US) 2012-06-27 EP disclosed
US-20090060986-A1 Transdermal delivery systems DURECT CORPORATION 2009-03-05 US disclosed
WO-2008066642-A2 TRANSDERMAL DELIVERY SYSTEMS COMPRISING BUPIVACAINE DURECT CORPORATION (US) 2008-06-05 WO disclosed