SCHEMBL13611166

SCHEMBL13611166

N=C1N[C@@H](C(N)=O)CN(C2CC2)[C@H]1CCCNC(N)=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
SCHEMBL14366044 0.87 SIRT2 (0.32) —
SCHEMBL13611124 0.80 SIRT2 (0.32) —
SCHEMBL12236129 0.80 SIRT2 (0.32) —
SCHEMBL12236104 0.80 SIRT2 (0.32) —
SCHEMBL13611181 0.80 SIRT2 (0.32) —
SCHEMBL13499207 0.80 SIRT2 (0.32) —
SCHEMBL13611182 0.76 SIRT2 (0.33) —
SCHEMBL13611169 0.73 FURIN (0.31) —
SCHEMBL18288918 0.71 SIRT2 (0.31) —
SCHEMBL13611172 0.68 ALB (0.34) —

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-7622440-B2 Cyclic natriuretic peptide constructs PALATIN TECHNOLOGIES, INC. (US) 2009-11-24 — — US disclosed
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