SCHEMBL21347351

SCHEMBL21347351

CC(C)N(C)NC(=O)NO

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.33
KDM4E B2RXH2 1/20 0.30
CA2 P00918 1/20 0.30
PTGS1 P23219 1/20 0.30
MMP12 P39900 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
SCHEMBL21499418 0.77 KDM4E (0.32) MMP3KDM4ECA2PTGS1MMP12
SCHEMBL11767844 0.74
SCHEMBL6771400 0.73
SCHEMBL23128366 0.72
Hydrochloric Acid SCHEMBL11766392 0.72 ALDH1A1 (0.33) KDM4ECA2PTGS1MMP12
SCHEMBL13993531 0.72 ALDH1A1 (0.34) CA2
SCHEMBL20364180 0.72
SCHEMBL23874452 0.70 DRD2 (0.38)
SCHEMBL1431647 0.67 ALDH1A1 (0.40) KDM4ECA2
SCHEMBL21565031 0.66

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11697693-B2 Nitric oxide-releasing alginates as biodegradable antibacterial scaffolds and methods pertaining thereto THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-07-11 US disclosed
US-11026965-B2 Nitric oxide-releasing cyclodextrins as biodegradable antibacterial scaffolds and methods pertaining thereto THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2021-06-08 US disclosed
WO-2020139857-A1 NITRIC OXIDE-RELEASING ANTIBACTERIAL POLYMERS AND SCAFFOLDS FABRICATED THEREFROM AND METHODS PERTAINING THERETO THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2020-07-02 WO disclosed
US-20190343869-A1 NITRIC OXIDE-RELEASING CYCLODEXTRINS AS BIODEGRADABLE ANTIBACTERIAL SCAFFOLDS AND METHODS PERTAINING THERETO THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2019-11-14 US disclosed
WO-2019173539-A1 NITRIC OXIDE-RELEASING CYCLODEXTRINS AS BIODEGRADABLE ANTIBACTERIAL SCAFFOLDS AND METHODS PERTAINING THERETO THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2019-09-12 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 (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-20190343869-A1 NITRIC OXIDE-RELEASING CYCLODEXTRINS AS BIODEGRADABLE ANTIBACTERIAL SCAFFOLDS AND METHODS PERTAINING THERETO NOS1, NOS2, NOS3 MMP3 3901/4885KDM4E 2810/4885CA2 942/4885
US-11026965-B2 Nitric oxide-releasing cyclodextrins as biodegradable antibacterial scaffolds and methods pertaining thereto NOS1, NOS2, NOS3 MMP3 3901/4885KDM4E 2810/4885CA2 942/4885
US-11697693-B2 Nitric oxide-releasing alginates as biodegradable antibacterial scaffolds and methods pertaining thereto NOS1, NOS2, NOS3 MMP3 1681/4885KDM4E 1736/4885CA2 654/4885

“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.