SCHEMBL3708189

SCHEMBL3708189

O=C(c1ccccc1)C(O)[C@H]1O[C@H](Br)[C@H](F)[C@@]1(O)C(=O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.33
LMNA P02545 1/20 0.33
CES1 P23141 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EPHX1 P07099 1/20 0.31
HIF1A Q16665 1/20 0.31
EPAS1 Q99814 1/20 0.31
ALKBH5 Q6P6C2 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
SCHEMBL22206336 1.00 CES2 (0.33) CES2LMNACES1TDP1L3MBTL1
SCHEMBL8744118 0.89 CES2 (0.33) CES2LMNACES1TDP1L3MBTL1
SCHEMBL28975466 0.86 CES2 (0.34) CES2LMNACES1TDP1L3MBTL1
SCHEMBL5492719 0.80 ALDH1A1 (0.34) CES2LMNACES1HIF1AEPAS1
SCHEMBL27818420 0.76 CES2 (0.33) CES2LMNACES1TDP1L3MBTL1
SCHEMBL27818419 0.76 CES2 (0.33) CES2LMNACES1TDP1L3MBTL1
SCHEMBL9064468 0.75 CES2 (0.34) CES2LMNACES1TDP1L3MBTL1
SCHEMBL28597160 0.75 CES2 (0.34) CES2LMNACES1TDP1L3MBTL1
SCHEMBL28597163 0.75 CES2 (0.34) CES2LMNACES1TDP1L3MBTL1
SCHEMBL28734198 0.75 CES2 (0.34) CES2LMNACES1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3134537-A1 METHOD FOR THE SYNTHESIS OF CLOFARABINE Synbias Pharma AG (CH) 2017-03-01 EP disclosed
WO-2015162175-A1 METHOD FOR THE SYNTHESIS OF CLOFARABINE SYNBIAS PHARMA AG (CH) 2015-10-29 WO disclosed
EP-2596005-A2 ANTIVIRAL AGENTS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2013-05-29 EP disclosed
WO-2010084115-A2 ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2010-07-29 WO disclosed
EP-1261350-A4 METHODS FOR SYNTHESIZING 2-CHLORO-9-(2-DEOXY-2-FLUORO-$g(b)-D-ARABINOFURANOSYL)- i 9H /i -PURIN-6-AMINE SOUTHERN RES INST (US) 2003-04-16 EP disclosed
EP-1261350-A1 METHODS FOR SYNTHESIZING 2-CHLORO-9-(2-DEOXY-2-FLUORO-$g(b)-D-ARABINOFURANOSYL)- i 9H /i -PURIN-6-AMINE Southern Research Institute (US) 2002-12-04 EP disclosed
WO-2001060383-A1 METHODS FOR SYNTHESIZING 2-CHLORO-9-(2-DEOXY-2-FLUORO-β-D-ARABINOFURANOSYL)-9H-PURIN-6-AMINE SOUTHERN RESEARCH INSTITUTE (US) 2001-08-23 WO disclosed
WO-1999044646-A1 NOVEL IMAGING AGENTS AND METHODS FOR THE PREPARATION AND USE THEREOF UNIVERSITY ADVANCED BIO-IMAGING ASSOCIATES (US) 1999-09-10 WO disclosed
EP-0629208-A1 FLUOROSUGAR DERIVATIVES OF MACROLIDES PFIZER INC. (US) 1994-12-21 EP disclosed
WO-1993018049-A1 FLUOROSUGAR DERIVATIVES OF MACROLIDES PFIZER INC. (US) 1993-09-16 WO disclosed
EP-0145978-A2 Nucleoside process Bristol-Myers Company (US) 1985-06-26 EP disclosed