SCHEMBL133019

SCHEMBL133019

CC(C)(C)OC(=O)C(O)CCCCN

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 6/20 0.44
GSR P00390 1/20 0.38
RNPEP Q9H4A4 1/20 0.37
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
NOS1 P29475 2/20 0.34
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
FFAR1 O14842 1/20 0.33
CYP1A2 P05177 1/20 0.33
ITGB3 P05106 2/20 0.33
ITGA2B P08514 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
SCHEMBL2567893 0.98 CPB2 (0.46) CPB2GSRRNPEPMEN1GAA
SCHEMBL2177004 0.94 CPB2 (0.38) CPB2GSRRNPEPMEN1GAA
SCHEMBL6537553 0.92 CPB2 (0.39) CPB2GSRRNPEPMEN1GAA
SCHEMBL9242626 0.88 GPR84 (0.42) CPB2MEN1GAAKMT2ANOS1
SCHEMBL6797401 0.86 NOS1 (0.36) CPB2MEN1GAAKMT2ANOS1
SCHEMBL7110422 0.86 NOS1 (0.36) CPB2MEN1GAAKMT2ANOS1
SCHEMBL28189283 0.86 CPB2 (0.40) CPB2GSRRNPEPMEN1GAA
SCHEMBL23151999 0.83 TDP1 (0.44) MEN1GAAKMT2ANOS1NOS3
SCHEMBL31460393 0.83 GPR84 (0.52) GPR84FFAR1
SCHEMBL3126968 0.82 CPB2 (0.41) CPB2GSRRNPEPMEN1GAA

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-20140187762-A1 Optical Sorting Method MEDICAL RESEARCH COUNCIL (GB) 2014-07-03 US disclosed
EP-1905828-B1 Optical sorting method MEDICAL RES COUNCIL (GB) 2012-08-08 EP disclosed
EP-1522581-B1 Optical sortingmethod MEDICAL RES COUNCIL (GB) 2012-03-07 EP disclosed
US-7897341-B2 Optical sorting method MEDICAL RESEARCH COUNCIL (GB) 2011-03-01 US disclosed
US-20090325236-A1 Optical sorting method GRIFFITHS ANDREW 2009-12-31 US disclosed
EP-1141272-B1 OPTICAL SORTING METHOD MEDICAL RES COUNCIL (GB) 2009-11-11 EP disclosed
US-20090053700-A1 Optical sorting method UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2009-02-26 US disclosed
EP-1905828-A2 Optical sorting method Medical Research Council (GB) 2008-04-02 EP disclosed
EP-1522582-B1 Optical sorting method MEDICAL RES COUNCIL (GB) 2007-07-04 EP disclosed
US-20050164239-A1 Compartmentalizing genetic elements into microcapsules, expressing elements to produce gene products within microcapsules, sorting elements using change in optical properties; in vitro evolution of nucleic acid through repeated mutagenesis MEDICAL RESEARCH COUNCIL (GB) 2005-07-28 US disclosed
EP-1522582-A2 Optical sorting method MEDICAL RESEARCH COUNCIL (GB) 2005-04-13 EP disclosed
EP-1522581-A2 Optical sortingmethod Medical Research Council (GB) 2005-04-13 EP disclosed
US-20050037392-A1 Compartmentalizing genetic elements into microcapsules, expressing elements to produce gene products within microcapsules, sorting elements using change in optical properties; in vitro evolution of nucleic acid through repeated mutagenesis MEDICAL RESEARCH COUNCIL (GB) 2005-02-17 US disclosed
US-6808882-B2 ISOLATING PREFERENTIAL NUCLEOTIDE SEQUENCES; OBTAIN NUCLEOTIDE SEQUENCE SAMPLES, ENCAPSULATE INTO MICROCAPSULES, MONITOR GENE EXPRESSION ACTIVITIES MEDICAL RESEARCH COUNCIL (GB) 2004-10-26 US disclosed
US-20020119459-A1 Optical sorting method UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2002-08-29 US disclosed
EP-1141272-A1 OPTICAL SORTING METHOD MEDICAL RESEARCH COUNCIL (GB) 2001-10-10 EP disclosed
WO-2000040712-A1 OPTICAL SORTING METHOD MEDICAL RESEARCH COUNCIL (GB) 2000-07-13 WO disclosed