SCHEMBL4962709

SCHEMBL4962709

CNC(=[O+]C)N(C)C.[O-]B(O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL19665 0.87
Hydrochloric Acid SCHEMBL5860643 0.85
Phosphoric Acid SCHEMBL1936779 0.79
SCHEMBL51352 0.78
Methylene Chloride SCHEMBL2347771 0.78
SCHEMBL4751122 0.78
SCHEMBL1952432 0.78
SCHEMBL118665 0.78
SCHEMBL7339903 0.76
SCHEMBL2234461 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572679-A4 CRFR1 SELECTIVE LIGANDS SALK INST FOR BIOLOGICAL STUDI (US) 2008-01-23 EP disclosed
EP-1572679-A2 CRFR1 SELECTIVE LIGANDS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2005-09-14 EP disclosed
WO-2003011823-A2 CRFR1 SELECTIVE LIGANDS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2003-02-13 WO disclosed