SCHEMBL3425339

SCHEMBL3425339

CC(C)(C)OC(=O)NOC(=O)C(O)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
KLK5 Q9Y337 2/20 0.49
CTSS P25774 3/20 0.49
CTSK P43235 2/20 0.49
CTSL P07711 1/20 0.49
CTSB P07858 1/20 0.49
ACE P12821 1/20 0.47
IDO1 P14902 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
PPARA Q07869 2/20 0.45
PPARG P37231 1/20 0.45
SYK P43405 1/20 0.45
ITGA4 P13612 1/20 0.44
ITGB7 P26010 1/20 0.44
AKT1 P31749 3/20 0.44
APP P05067 1/20 0.43

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
Water SCHEMBL27509393 0.99 CTSS (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL28205495 0.87 ATM (0.52) ATMKLK5CTSSCTSKCTSL
SCHEMBL6345188 0.86 CTSK (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL29077117 0.86 ATM (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL30759366 0.84 ITGA4 (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL487422 0.84 ITGA4 (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL487423 0.84 ITGA4 (0.51) ATMKLK5CTSSCTSKCTSL
SCHEMBL5994752 0.82 SRR (0.47)
SCHEMBL8583257 0.81 ALPI (0.47)
SCHEMBL28251018 0.81 CTSK (0.52) ATMCTSSCTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2247582-A2 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING SAME Aventis Pharma S.A. (FR) 2010-11-10 EP claimed
WO-2009115655-A2 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING SAME AVENTIS PHARMA S.A. (FR) 2009-09-24 WO claimed
EP-2791122-A1 CRYSTALLINE FORM OF CABAZITAXEL AND PROCESS FOR PREPARING THE SAME Aventis Pharma S.A. (FR) 2014-10-22 EP disclosed
WO-2013088335-A1 CRYSTALLINE FORM OF CABAZITAXEL AND PROCESS FOR PREPARING THE SAME AVENTIS PHARMA S.A. (FR) 2013-06-20 WO disclosed
WO-2010128258-A1 ANTITUMOR COMBINATION INCLUDING CABAZITAXEL AND CAPECITABINE SANOFI-AVENTIS (FR) 2010-11-11 WO disclosed
EP-1694660-A1 PROCESS FOR THE PREPARATION OF ANHYDROUS AND HYDRATED ACTIVE PHARMACEUTICAL INGREDIENTS (APIS); STABLE PHARMACEUTICAL COMPOSITIONS PREPARED FROM THE SAME AND USES OF SAID COMPOSITIONS Quiral Quimica Do Brasil (BR) 2006-08-30 EP disclosed
EP-1140064-B1 ORAL ADMINISTRATION OF TAXOID DERIVATIVES AVENTIS PHARMA SA (FR) 2006-02-15 EP disclosed
WO-2005061474-A1 PROCESS FOR THE PREPARATION OF ANHYDROUS AND HYDRATED ACTIVE PHARMACEUTICAL INGREDIENTS (APIS); STABLE PHARMACEUTICAL COMPOSITIONS PREPARED FROM THE SAME AND USES OF SAID COMPOSITIONS QUIRAL QUÍMICA DO BRASIL (BR) 2005-07-07 WO disclosed
US-6403634-B1 FOR TREATING ABNORMAL CELL PROLIFERATION AVENTIS PHARMA S.A. (FR) 2002-06-11 US disclosed
US-6346543-B1 ADMINISTERING BACCATIN DERIVATIVE AS ANTICARCINOGENIC AGENT AVENTIS PHARMA S.A. (FR) 2002-02-12 US disclosed
EP-1140064-A2 ORAL ADMINISTRATION OF TAXOID DERIVATIVES Aventis Pharma S.A. (FR) 2001-10-10 EP disclosed
EP-1109547-A1 NEW USE OF TAXOID DERIVATIVES Aventis Pharma S.A. (FR) 2001-06-27 EP disclosed
EP-1105119-A2 NEW USE OF TAXOID DERIVATIVES Aventis Pharma S.A. (FR) 2001-06-13 EP disclosed
WO-2000041482-A2 ORAL ADMINISTRATION OF TAXOID DERIVATIVES AVENTIS PHARMA S.A. (FR) 2000-07-20 WO disclosed
EP-1020188-A1 New use of taxoid derivatives Aventis Pharma S.A. (FR) 2000-07-19 EP disclosed
WO-2000010547-A2 NEW USE OF TAXOID DERIVATIVES AVENTIS PHARMA S.A. (FR) 2000-03-02 WO disclosed
EP-0982028-A1 New use of taxoid derivatives Aventis Pharma S.A. (FR) 2000-03-01 EP disclosed
EP-0982027-A1 Taxoid derivatives for treating abnormal cell proliferation of the brain Aventis Pharma S.A. (FR) 2000-03-01 EP disclosed
WO-2000009120-A1 NEW USE OF TAXOID DERIVATIVES AVENTIS PHARMA S.A. (FR) 2000-02-24 WO disclosed