Creatine

Creatine

SCHEMBL3807770

CN(CC(=O)[O-])C(=N)N.[K+]

nearest known ligand 0.41

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Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

The experimentally established mechanism targets of Creatine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 18/20 0.41
▸ CA2 P00918 18/20 0.41
▸ NOS3 P29474 1/20 0.39
▸ NOS1 P29475 1/20 0.39
▸ NOS2 P35228 1/20 0.39

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 SCHEMBL7858043 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL4885845 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL3816605 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL6673726 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL5569335 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL675800 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL4269044 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL9391271 0.93 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL9568829 0.92 NOS3 (0.39) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL1065566 0.88 NOS3 (0.39) CA1CA2NOS3NOS1NOS2

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
US-7226947-B1 Use of creatine as a fat substitute ALZCHEM TROSTBERG GMBH (DE) 2007-06-05 — — US claimed
EP-1176875-B1 USE OF CREATINE AS A FEED SUBSTITUTE DSM FINE CHEM AUSTRIA GMBH (AT) 2005-01-19 — — EP claimed
EP-3307064-B1 LONG TERM STORAGE AND PRESERVATION OF PLATELETS HARVARD COLLEGE (US) 2023-09-06 — — EP disclosed
US-20190045776-A1 LONG TERM STORAGE AND PRESERVATION OF PLATELETS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-02-14 — — US disclosed
EP-3307064-A1 LONG TERM STORAGE AND PRESERVATION OF PLATELETS President and Fellows of Harvard College (US) 2018-04-18 — — EP disclosed
WO-2016201121-A1 LONG TERM STORAGE AND PRESERVATION OF PLATELETS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-12-15 — — WO disclosed
US-7511164-B2 Enhanced bioavailability; reacting creatine, fatty acid and thionyl halide MULTI FORMULATIONS LTD (CA) 2009-03-31 — — US disclosed
WO-2008101309-A1 CREATINE-FATTY ACIDS MULTI FORMULATIONS LTD. (CA) 2008-08-28 — — WO disclosed
US-20080200723-A1 CREATINE-FATTY ACIDS MULTI FORMULATIONS LTD. (CA) 2008-08-21 — — US disclosed
US-7314945-B1 Creatine-fatty acids MULTI FORMULATIONS LTD. (CA) 2008-01-01 — — US disclosed
US-7226947-B1 Use of creatine as a fat substitute ALZCHEM TROSTBERG GMBH (DE) 2007-06-05 — — US disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20080200723-A1 CREATINE-FATTY ACIDS FABP2, FABP3, FABP1 CA1 742/4885CA2 349/4885NOS3 2786/4885

“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.

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