Creatine

Creatine

SCHEMBL4281967

CC(O)CC(=O)O.CN(CC(=O)O)C(=N)N

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
CA1 P00915 9/20 0.33
CA2 P00918 9/20 0.33
GABRR1 P24046 2/20 0.32
LMNA P02545 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32

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
Creatine SCHEMBL31156412 0.89 NOS3 (0.44) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL8580872 0.87 NOS3 (0.41) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL1883324 0.85 NOS3 (0.46) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL30063981 0.84
Creatine SCHEMBL27979093 0.84 NOS3 (0.46) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL4007614 0.84 NOS3 (0.46) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL21567 0.84
Creatine SCHEMBL623785 0.84 SMN1; SMN2 (0.52) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL29400407 0.84 SMN1; SMN2 (0.52) NOS3NOS1NOS2CA1CA2
Creatine SCHEMBL29404550 0.84 SMN1; SMN2 (0.52) NOS3NOS1NOS2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11806328-B2 Metabolic therapy for wound healing UNIVERSITY OF SOUTH FLORIDA (US) 2023-11-07 US claimed
US-20210093602-A1 METABOLIC THERAPY FOR WOUND HEALING UNIVERSITY OF SOUTH FLORIDA 2021-04-01 US claimed
US-10864184-B1 Metabolic therapy for wound healing UNIVERSITY OF SOUTH FLORIDA (US) 2020-12-15 US claimed
US-20200268701-A1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS UNIV SOUTH FLORIDA (US) 2020-08-27 US claimed
US-10646462-B2 Compositions and methods for producing elevated and sustained ketosis UNIVERSITY OF SOUTH FLORIDA (US) 2020-05-12 US claimed
WO-2019200132-A1 COMPOSITIONS AND METHODS FOR SUPPLEMENTING THE DIET Metabolic Recovery Systems, LLC (US) 2019-10-17 WO claimed
US-20190313682-A1 COMPOSITIONS AND METHODS FOR SUPPLEMENTING THE DIET Metabolic Recovery Systems, LLC 2019-10-17 US claimed
EP-2976073-B1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS UNIV SOUTH FLORIDA (US) 2019-08-28 EP claimed
US-20180021281-A1 LIPID FORMULATIONS CONTAINING BIOACTIVE FATTY ACIDS AND OTHER BIOACTIVE AGENTS SCIADONICS, INC. 2018-01-25 US claimed
WO-2018017667-A1 LIPID FORMULATIONS CONTAINING BIOACTIVE FATTY ACIDS AND OTHER BIOACTIVE AGENTS SCIADONICS, INC. (US) 2018-01-25 WO claimed
US-20160067207-A1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS UNIVERSITY OF SOUTH FLORIDA (US) 2016-03-10 US claimed
EP-2976073-A1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS University Of South Florida (US) 2016-01-27 EP claimed
US-9138420-B2 Compositions and methods for producing elevated and sustained ketosis UNIVERSITY OF SOUTH FLORIDA (US) 2015-09-22 US claimed
US-20140350105-A1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS UNIVERSITY OF SOUTH FLORIDA (US) 2014-11-27 US claimed
WO-2014153416-A1 COMPOSITIONS AND METHODS FOR PRODUCING ELEVATED AND SUSTAINED KETOSIS UNIVERSITY OF SOUTH FLORIDA (US) 2014-09-25 WO claimed
EP-2567705-A2 Methods of treating cognitive dysfunction by modulating brain energy metabolism Avicena Group, Inc. (US) 2013-03-13 EP claimed
US-20060241021-A1 Methods of treating cognitive dysfunction by modulating brain energy metabolism UNIVERSITY OF CINCINNATI CHILDREN'S HOSPITAL MEDICAL CENTER 2006-10-26 US claimed
EP-1567180-A2 METHODS OF TREATING COGNITIVE DYSFUNCTION BY MODULATING BRAIN ENERGY METABOLISM Avicena Group, Inc. (US) 2005-08-31 EP claimed
US-20040126366-A1 Methods of treating cognitive dysfunction by modulating brain energy metabolism CINCINNATI, UNIVERSITY OF 2004-07-01 US claimed
WO-2003101402-A2 METHODS OF TREATING COGNITIVE DYSFUNCTION BY MODULATING BRAIN ENERGY METABOLISM AVICENA GROUP, INC. (US) 2003-12-11 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060241021-A1 Methods of treating cognitive dysfunction by modulating brain energy metabolism PC, PYGB, PCK2 NOS3 728/4885NOS1 822/4885NOS2 694/4885
US-20040126366-A1 Methods of treating cognitive dysfunction by modulating brain energy metabolism PC, PYGB, PCK2 NOS3 728/4885NOS1 822/4885NOS2 694/4885
US-20180021281-A1 LIPID FORMULATIONS CONTAINING BIOACTIVE FATTY ACIDS AND OTHER BIOACTIVE AGENTS FAAH, ELOVL1, DGKA NOS3 1912/4885NOS1 1767/4885NOS2 1862/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.