SCHEMBL5333427

SCHEMBL5333427

CN1CCNCC1c1ccc(N)c(N)c1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 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
SCHEMBL3279337 0.82 CHRNB2 (0.36) TAAR1
SCHEMBL8775410 0.78 SLC6A2 (0.49)
SCHEMBL5734703 0.77 KDM4E (0.41)
SCHEMBL6026785 0.77 ADRB1 (0.43)
SCHEMBL658173 0.76 PDE4B (0.46)
SCHEMBL27326756 0.76 HTR3A (0.47)
SCHEMBL7400548 0.76 MAOB (0.39)
SCHEMBL4300202 0.75 MAOB (0.45)
SCHEMBL9056832 0.75 HTR2C (0.49)
SCHEMBL18913839 0.75 CHRNB2 (0.55) TAAR1

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-2007045096-A1 OLIGOHETEROAROMATIC LUMINISCENT ASSEMBLIES AS HIGH-AFFINITY DNA SEQUENCE-DIRECTED LIGANDS UNIVERSITY OF SASKATCHEWAN (CA) 2007-04-26 WO disclosed