SCHEMBL2319309

SCHEMBL2319309

NCCC(=O)NC(Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.38
PARP3 Q9Y6F1 1/20 0.38
HDAC6 Q9UBN7 4/20 0.33
HDAC1 Q13547 2/20 0.33
MMP2 P08253 2/20 0.33
MMP8 P22894 1/20 0.33
MMP12 P39900 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
MMP1 P03956 1/20 0.32
FCER2 P06734 1/20 0.32
LMNA P02545 1/20 0.32
TERT O14746 2/20 0.31
REN P00797 1/20 0.31
MMP3 P08254 1/20 0.31
HPGDS O60760 1/20 0.30

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
Carnosine SCHEMBL1161010 0.89 ITGB3 (0.41) ITGB3ITGA2B
Carnosine SCHEMBL33768 0.89 ITGB3 (0.41) ITGB3ITGA2B
Carnosine SCHEMBL33769 0.89 ITGB3 (0.41) ITGB3ITGA2B
Carnosine SCHEMBL3904964 0.89 ITGB3 (0.41) ITGB3ITGA2B
SCHEMBL30918646 0.89 SLC15A2 (0.35) PARP1PARP3MMP1FCER2
Carnosine SCHEMBL1641133 0.88 ITGB3 (0.40) ITGB3ITGA2B
Carnosine SCHEMBL11033195 0.88 ITGB3 (0.40) ITGB3ITGA2B
Carnosine SCHEMBL308693 0.88 ITGB3 (0.40) ITGB3ITGA2B
Carnosine SCHEMBL134705 0.88 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL2633410 0.88 PARP1 (0.37) PARP1PARP3MMP2MMP8MMP12

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
WO-2020011235-A1 SKIN MOISTURE RETENTION COMPOSITION AND SKIN BEAUTY METHOD THEREFOR 久文股份有限公司 2020-01-16 WO claimed
WO-2020011235-A1 SKIN MOISTURE RETENTION COMPOSITION AND SKIN BEAUTY METHOD THEREFOR 久文股份有限公司 2020-01-16 WO disclosed
CN-106795122-B Nitric Oxide Donor Carnosine Compounds 尼科斯股份有限公司 2019-09-27 CN disclosed
US-10093696-B2 Nitric oxide donating carnosine compounds NICOX SCIENCE IRELAND (IE) 2018-10-09 US disclosed
US-20170291920-A1 NITRIC OXIDE DONATING CARNOSINE COMPOUNDS NICOX SA (FR) 2017-10-12 US disclosed
CN-106795122-A Nitric oxide donor carnosine compounds 尼科斯科学爱尔兰公司 2017-05-31 CN disclosed
EP-2993172-B1 Nitric oxide donating carnosine compounds NICOX SCIENCE IRELAND (IE) 2017-04-19 EP disclosed
WO-2016034619-A1 NITRIC OXIDE DONATING CARNOSINE COMPOUNDS NICOX SCIENCE IRELAND (IE) 2016-03-10 WO disclosed
EP-2993172-A1 Nitric oxide donating carnosine compounds Nicox Science Ireland (IE) 2016-03-09 EP disclosed
US-8293943-B1 Prevention of cellular senescence in mammals by natural peptide complexes ISLAND KINETICS, INC. (US) 2012-10-23 US disclosed
US-20120264696-A1 PREVENTION OF CELLULAR SENESCENCE IN MAMMALS BY NATURAL PEPTIDE COMPLEXES ISLAND KINETICS INC. (US) 2012-10-18 US disclosed
US-8258343-B1 Prevention of cellular senescence in mammals by natural peptide complexes ISLAND KINETICS, INC. (US) 2012-09-04 US disclosed
US-8212076-B2 Prevention of cellular senescence in mammals by natural peptide complexes Covalence, Inc. (US) 2012-07-03 US disclosed
US-20110190202-A1 Prevention of Cellular Senescence in Mammals by Natural Peptide Complexes ISLAND KINETICS INC. (US) 2011-08-04 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 (4 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-20170291920-A1 NITRIC OXIDE DONATING CARNOSINE COMPOUNDS NOS1, NOS2, NOS3 PARP1 673/4885PARP3 1913/4885HDAC6 2489/4885
US-10093696-B2 Nitric oxide donating carnosine compounds NOS1, NOS2, NOS3 PARP1 673/4885PARP3 1913/4885HDAC6 2489/4885
US-20120264696-A1 PREVENTION OF CELLULAR SENESCENCE IN MAMMALS BY NATURAL PEPTIDE COMPLEXES COL14A1, TP53, CUTA PARP1 1421/4885PARP3 2562/4885HDAC6 534/4885
US-20110190202-A1 Prevention of Cellular Senescence in Mammals by Natural Peptide Complexes COL14A1, TP53, CUTA PARP1 1421/4885PARP3 2562/4885HDAC6 534/4885

“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.