SCHEMBL22375468

SCHEMBL22375468

CSCN[C@@H](CCCCN=[N+]=[N-])C(=O)C(C)C

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
SCHEMBL22375471 0.84 FOLH1 (0.32) —
SCHEMBL24012407 0.81 CNR2 (0.32) —
SCHEMBL20980231 0.80 ADRB2 (0.32) —
SCHEMBL22375470 0.79 CNR2 (0.32) —
SCHEMBL21297373 0.77 KDM4E (0.32) —
SCHEMBL24468878 0.71 — —
SCHEMBL20980230 0.69 ALB (0.38) —
SCHEMBL24012449 0.69 FOLH1 (0.30) —
SCHEMBL15706851 0.68 FOLH1 (0.32) —
SCHEMBL13448062 0.68 FOLH1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200268898-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC. 2020-08-27 — — US disclosed
Send feedback