SCHEMBL5568466

SCHEMBL5568466

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

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
CA1 P00915 18/20 0.35
CA2 P00918 18/20 0.35
CA12 O43570 1/20 0.32
CA9 Q16790 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
SCHEMBL3812152 0.79 NOS3 (0.39) NOS3NOS1NOS2CA1CA2
SCHEMBL3056410 0.78 CA1 (0.41) NOS3NOS1NOS2CA1CA2
Water SCHEMBL21810558 0.78 NOS3 (0.38) NOS3NOS1NOS2CA1CA2
SCHEMBL19152428 0.78 CA1 (0.42) NOS3NOS1NOS2CA1CA2
SCHEMBL13897077 0.78 NOS3 (0.38) NOS3NOS1NOS2CA1CA2
SCHEMBL4594552 0.77 TSHR (0.41) NOS3NOS1NOS2CA1CA2
SCHEMBL28254066 0.76 NOS3 (0.37) NOS3NOS1NOS2CA1CA2
SCHEMBL5326458 0.76 NOS3 (0.37) NOS3NOS1NOS2CA1CA2
SCHEMBL2774046 0.76 CA1 (0.40) NOS3NOS1NOS2CA1CA2
SCHEMBL5563660 0.76 CA1 (0.35) 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 14 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
US-11970435-B2 Taste-modified creatine salts, compounds, compositions and uses thereof AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2024-04-30 US disclosed
US-20230201115-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC 2023-06-29 US disclosed
US-11633354-B2 Creatine and/or creatinine compositions and related methods THERMOLIFE INTERNATIONAL, LLC (US) 2023-04-25 US disclosed
US-20230062170-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC 2023-03-02 US disclosed
US-11154499-B2 Creatine and/or creatinine compositions and related methods THERMOLIFE INTERNATIONAL, LLC (US) 2021-10-26 US disclosed
US-20210251895-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC 2021-08-19 US disclosed
US-20200246262-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC (US) 2020-08-06 US disclosed
US-20200148632-A1 TASTE-MODIFIED CREATINE SALTS, COMPOUNDS, COMPOSITIONS AND USES THEREOF AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. 2020-05-14 US disclosed
US-20190298667-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC 2019-10-03 US disclosed
WO-2019191338-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS THERMOLIFE INTERNATIONAL, LLC (US) 2019-10-03 WO disclosed
WO-2018208647-A1 TASTE-MODIFIED CREATINE SALTS, COMPOUNDS, COMPOSITIONS AND USES THEREOF AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2018-11-15 WO disclosed
US-20170142993-A1 CREATINE-PROTEIN MATRIX AND METHOD FOR PRODUCING SAID MATRIX ALZCHEM AG (DE) 2017-05-25 US disclosed
WO-2008101309-A1 CREATINE-FATTY ACIDS MULTI FORMULATIONS LTD. (CA) 2008-08-28 WO 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 (9 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-20200246262-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS MB, CKMT1A; CKMT1B, REN NOS3 3285/4885NOS1 2779/4885NOS2 2173/4885
US-11154499-B2 Creatine and/or creatinine compositions and related methods MB, CKMT1A; CKMT1B, REN NOS3 3285/4885NOS1 2779/4885NOS2 2173/4885
US-20190298667-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS CKMT1A; CKMT1B, REN, ALB NOS3 3810/4885NOS1 4018/4885NOS2 3880/4885
US-20230201115-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS CKMT1A; CKMT1B, REN, ALB NOS3 4094/4885NOS1 4060/4885NOS2 3835/4885
US-11633354-B2 Creatine and/or creatinine compositions and related methods MB, CKMT1A; CKMT1B, REN NOS3 3285/4885NOS1 2779/4885NOS2 2173/4885
US-20200148632-A1 TASTE-MODIFIED CREATINE SALTS, COMPOUNDS, COMPOSITIONS AND USES THEREOF CKMT1A; CKMT1B, TAS2R16, TAS2R4 NOS3 1870/4885NOS1 2192/4885NOS2 2324/4885
US-20230062170-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS CKMT1A; CKMT1B, REN, ALB NOS3 3810/4885NOS1 4018/4885NOS2 3880/4885
US-20210251895-A1 CREATINE AND/OR CREATININE COMPOSITIONS AND RELATED METHODS MB, CKMT1A; CKMT1B, REN NOS3 3285/4885NOS1 2779/4885NOS2 2173/4885
US-11970435-B2 Taste-modified creatine salts, compounds, compositions and uses thereof CKMT1A; CKMT1B, TAS2R16, TAS2R4 NOS3 1870/4885NOS1 2192/4885NOS2 2324/4885

“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.