SCHEMBL7913837

SCHEMBL7913837

N#CCC(=O)C1CN2CCC1C2

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 4/20 0.45
▸ CHRM2 P08172 3/20 0.45
▸ CHRM4 P08173 3/20 0.45
▸ CHRM3 P20309 3/20 0.45
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CHRM5 P08912 1/20 0.36

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
SCHEMBL6626986 0.98 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM3MEN1
SCHEMBL9523751 0.77 CHRM2 (0.41) CHRM1CHRM2CHRM4CHRM3MEN1
Hydrochloric Acid SCHEMBL8935473 0.75 PEPD (0.43) CHRM1CHRM2CHRM4CHRM3MEN1
Bromide SCHEMBL9293238 0.75 CHRM2 (0.37) CHRM1CHRM2CHRM4CHRM3MEN1
SCHEMBL8935481 0.72 CHRM2 (0.36) CHRM1CHRM2CHRM4CHRM3MEN1
SCHEMBL12043270 0.72 CHRM2 (0.63) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL7430050 0.72 CHRM2 (0.63) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL7493133 0.71 CHRM2 (0.42) CHRM1CHRM2CHRM4CHRM3MEN1
SCHEMBL4339192 0.71 CHRM2 (0.42) CHRM1CHRM2CHRM4CHRM3MEN1
SCHEMBL4762996 0.71 CHRM2 (0.42) CHRM1CHRM2CHRM4CHRM3MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871445-A4 COMPOSITION FOR TREATING PAIN LILLY CO ELI (US) 2001-01-10 — — EP claimed
JP-2000501709-A — — 2000-02-15 — — JP claimed
EP-0871445-A1 COMPOSITION FOR TREATING PAIN ELI LILLY AND COMPANY (US) 1998-10-21 — — EP claimed
WO-1997020561-A1 COMPOSITION FOR TREATING PAIN ELI LILLY AND COMPANY (US) 1997-06-12 — — WO claimed
Send feedback