SCHEMBL4789106

SCHEMBL4789106

COCCOC1CCC(N2CCC(N)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL4789105 1.00 CHRM1 (0.31) CHRM1GNAI3GNAO1GNAI1NPC1
SCHEMBL602982 0.85 GNAI3 (0.35) CHRM1GNAI3GNAO1GNAI1NPC1
SCHEMBL602981 0.85 GNAI3 (0.35) CHRM1GNAI3GNAO1GNAI1NPC1
Hydrochloric Acid SCHEMBL601271 0.83 GNAI3 (0.38) CHRM1GNAI3GNAO1GNAI1NPC1
Hydrochloric Acid SCHEMBL601270 0.83 GNAI3 (0.38) CHRM1GNAI3GNAO1GNAI1NPC1
SCHEMBL602533 0.82 CHRM1 (0.37) CHRM1GNAI3GNAO1GNAI1
SCHEMBL602532 0.82 CHRM1 (0.37) CHRM1GNAI3GNAO1GNAI1
SCHEMBL23329136 0.82
SCHEMBL1241366 0.82
SCHEMBL1241364 0.82

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-2008119721-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed