SCHEMBL850489

SCHEMBL850489

N=C(CNC=O)NC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.51
AMDHD2 Q9Y303 1/20 0.42
IGF2R P11717 4/20 0.40
ATIC P31939 2/20 0.38
UMPS P11172 2/20 0.35
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 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
SCHEMBL29601624 1.00 FBP1 (0.51) FBP1AMDHD2IGF2RATICUMPS
SCHEMBL13176580 0.86 FBP1 (0.53) FBP1AMDHD2IGF2RATIC
SCHEMBL4362008 0.86 FBP1 (0.53) FBP1AMDHD2IGF2RATIC
SCHEMBL849806 0.86 FBP1 (0.53) FBP1AMDHD2IGF2RATIC
SCHEMBL4362015 0.86 FBP1 (0.53) FBP1AMDHD2IGF2RATIC
SCHEMBL29975460 0.80 FBP1 (0.44) FBP1AMDHD2IGF2RATIC
SCHEMBL13176934 0.75 FBP1 (0.51) FBP1AMDHD2IGF2RATICUMPS
SCHEMBL29366110 0.74 FBP1 (0.62) FBP1AMDHD2IGF2RATICUMPS
SCHEMBL16492065 0.74 FBP1 (0.62) FBP1AMDHD2IGF2RATICUMPS
SCHEMBL2510321 0.74 FBP1 (0.50) FBP1AMDHD2IGF2RATICUMPS

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8494779-B2 Method for screening essential metabolites in growth of microorganisms KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US claimed
US-20100143911-A1 METHOD FOR SCREENING ESSENTIAL METABOLITES IN GROWTH OF MICROORGANISMS KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-06-10 US claimed
US-20250037787-A1 CONCENTRATION BOUNDS IN LARGE NETWORKS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2025-01-30 US disclosed
EP-2463654-B1 Compositions and methods for modeling saccharomyces cerevisiae metabolism UNIV CALIFORNIA (US) 2020-06-03 EP disclosed
EP-2401696-B1 MAMMALIAN CELL LINE MODELS AND RELATED METHODS INTREXON CEU INC (US) 2017-06-21 EP disclosed
US-20140309186-A1 Metabolomics-Based Identification of Disease-Causing Agents GEORGIA TECH RESEARCH CORPORATION 2014-10-16 US disclosed
EP-1720976-B1 METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL INSILICO BIOTECHNOLOGY AG (DE) 2014-10-08 EP disclosed
US-8494779-B2 Method for screening essential metabolites in growth of microorganisms KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US disclosed
US-8311790-B2 Reverse engineering genome-scale metabolic network reconstructions for organisms with incomplete genome annotation and developing constraints using proton flux states and numerically-determined sub-systems UNIVERSITY OF DELAWARE (US) 2012-11-13 US disclosed
US-20120191434-A1 ARTICLES OF MANUFACTURE AND METHODS FOR MODELING CHINESE HAMSTER OVARY (CHO) CELL METABOLISM GT LIFE SCIENCES, INC. (US) 2012-07-26 US disclosed
EP-2463654-A1 Compositions and methods for modeling saccharomyces cerevisiae metabolism The Regents of The University of California (US) 2012-06-13 EP disclosed
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed
US-7751981-B2 Articles of manufacture and methods for modeling Saccharomyces cerevisiae metabolism THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-07-06 US disclosed
US-20100143911-A1 METHOD FOR SCREENING ESSENTIAL METABOLITES IN GROWTH OF MICROORGANISMS KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-06-10 US disclosed
US-20090259451-A1 REVERSE ENGINEERING GENOME-SCALE METABOLIC NETWORK RECONSTRUCTIONS FOR ORGANISMS WITH INCOMPLETE GENOME ANNOTATION AND DEVELOPING CONSTRAINTS USING PROTON FLUX STATES AND NUMERICALLY-DETERMINED SUB-SYSTEMS UNIVERSITY OF DELAWARE (US) 2009-10-15 US disclosed
US-7585617-B2 For liberating and isolating component materials contained in a biological cell and for qualitative detection and quantitative determination of the liberated materials INSILICO BIOTECHNOLOGY GMBH (DE) 2009-09-08 US disclosed
US-20090186358-A1 Pathway Analysis of Cell Culture Phenotypes and Uses Thereof WYETH (US) 2009-07-23 US disclosed
US-20070298484-A1 Method and Device for Thermal Conditioning of a Cell INSILICO BIOTECHNOLOGY GMBH (DE) 2007-12-27 US disclosed
EP-1720976-A1 METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL Insilico Biotechnology Gmbh (DE) 2006-11-15 EP disclosed
WO-2005083054-A1 METHOD AND DEVICE FOR THERMAL CONDITIONING OF A CELL INSILICO BIOTECHNOLOGY GMBH (DE) 2005-09-09 WO disclosed