SCHEMBL2469082

SCHEMBL2469082

CC(C)(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(=O)c1ccc(O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.40
CA2 P00918 5/20 0.36
CA1 P00915 4/20 0.36
CA12 O43570 3/20 0.36
CA7 P43166 3/20 0.36
CA9 Q16790 3/20 0.36
CA14 Q9ULX7 3/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
THRB P10828 1/20 0.35
RECQL P46063 1/20 0.35
PLEC Q15149 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CPT1B Q92523 1/20 0.34
ESR1 P03372 2/20 0.33

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
SCHEMBL4415126 0.94 CA2 (0.41) ELANECA2CA1CA12CA7
SCHEMBL4418782 0.85 MAPT (0.47) ELANECA2CA1MAPK1MAPT
SCHEMBL4419675 0.80 CES2 (0.44) ELANECA2CA1MAPK1MAPT
SCHEMBL4425313 0.75 CA1 (0.47) CA2CA1MAPTGAAL3MBTL1
SCHEMBL4418034 0.75 GAA (0.41) CA2CA1MAPTGAAL3MBTL1
SCHEMBL14515007 0.70 ALDH5A1 (0.47) ELANECA2CA1CA12CA7
SCHEMBL29405115 0.69 ELANE (0.44) ELANELMNAMLYCD
SCHEMBL9416830 0.68 DGAT1 (0.43) THRB
SCHEMBL2174033 0.66 CES1 (0.62) CA2CA1CA12CA7CA9
SCHEMBL759623 0.66 ESR1 (0.52) ELANECA2CA1CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1631616-B1 NOVEL SURFACE-ACTIVE POLYSILOXANE PHOTOINITIATORS BASF SE (DE) 2011-10-05 EP disclosed
EP-1631616-B1 NOVEL SURFACE-ACTIVE POLYSILOXANE PHOTOINITIATORS BASF SE (DE) 2011-10-05 EP disclosed
EP-1392779-B1 FLUORINATED-PHOTOINITIATORS IN DUAL CURE RESINS CIBA HOLDING INC (CH) 2009-04-22 EP disclosed
EP-1392779-B1 FLUORINATED-PHOTOINITIATORS IN DUAL CURE RESINS CIBA HOLDING INC (CH) 2009-04-22 EP disclosed
CN-100432122-C Novel surface-active polysiloxane photoinitiators CIBA SC HOLDING AG (CH) 2008-11-12 CN disclosed
US-20070026509-A1 Novel surface-active polysiloxane photoinitiators CIBA SPECIALTY CHEMICALS CORP. 2007-02-01 US disclosed
US-20070026509-A1 Novel surface-active polysiloxane photoinitiators CIBA SPECIALTY CHEMICALS CORP. 2007-02-01 US disclosed
US-20070026509-A1 Novel surface-active polysiloxane photoinitiators CIBA SPECIALTY CHEMICALS CORP. 2007-02-01 US disclosed
CN-1798793-A Novel surface-active polysiloxane photoinitiators CIBA SC HOLDING AG (CH) 2006-07-05 CN disclosed
EP-1631616-A1 NOVEL SURFACE-ACTIVE POLYSILOXANE PHOTOINITIATORS Ciba SC Holding AG (CH) 2006-03-08 EP disclosed
CN-1235984-C Fluorinated-photoinitiators in dual cure resins CIBA SC HOLDING AG (CH) 2006-01-11 CN disclosed
WO-2004108799-A1 NOVEL SURFACE-ACTIVE POLYSILOXANE PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-12-16 WO disclosed
US-20040067311-A1 Fluorinated-photoinitiators in dual cure resins CIBA SPECIALTY CHEMICALS CORP. 2004-04-08 US disclosed
EP-1392779-A1 FLUORINATED-PHOTOINITIATORS IN DUAL CURE RESINS Ciba SC Holding AG (CH) 2004-03-03 EP disclosed
CN-1474862-A Fluorinated-photoinitiators in dual cure resins �������⻯ѧƷ�ع����޹�˾ 2004-02-11 CN disclosed
WO-2002040602-A1 FLUORINATED-PHOTOINITIATORS IN DUAL CURE RESINS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-05-23 WO disclosed