SCHEMBL20121264

SCHEMBL20121264

CN1CCCCCCN(C)CN(C)CCCCN(C)C1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.33
MGLL Q99685 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
SCHEMBL14393594 1.00 HRH3 (0.33) HRH3MGLL
SCHEMBL17771603 1.00 HRH3 (0.33) HRH3MGLL
SCHEMBL18774271 1.00 HRH3 (0.33) HRH3MGLL
SCHEMBL15471693 1.00 HRH3 (0.33) HRH3MGLL
SCHEMBL13964214 1.00 HRH3 (0.33) HRH3MGLL
SCHEMBL22228552 0.96 HRH3 (0.32) HRH3MGLL
SCHEMBL13007041 0.96
SCHEMBL1074174 0.92
SCHEMBL22228574 0.89 TDP1 (0.35) MGLL
SCHEMBL230431 0.88

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-9962447-B2 Supramolecular aggregates comprising maleimido cores UFPEPTIDES S.R.L. (IT) 2018-05-08 US disclosed