SCHEMBL2635751

SCHEMBL2635751

NCCN(N)C(=O)c1cnc(C(=O)N(N)CCN)cn1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.34
MAOB P27338 1/20 0.34
ADRA2C P18825 1/20 0.32

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
SCHEMBL588733 0.76 SIRT6 (0.47) SIRT6MAOB
SCHEMBL8167024 0.69 P2RX7 (0.38)
SCHEMBL7105124 0.67 L3MBTL1 (0.41) SIRT6
SCHEMBL10717957 0.64 TTR (0.31)
SCHEMBL7108522 0.64 SMO (0.40)
SCHEMBL23417258 0.64 TDP1 (0.41) MAOB
SCHEMBL15759510 0.63 GSK3B (0.35) SIRT6
SCHEMBL22677556 0.63
SCHEMBL28074220 0.63
SCHEMBL8260551 0.62 SIRT6 (0.58) SIRT6

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
WO-2011143540-A1 UNIFORM, FUNCTIONALIZED, CROSS-LINKED NANOSTRUCTURES FOR MONITORING pH MALLINCKRODT LLC (US) 2011-11-17 WO disclosed