SCHEMBL7811397

SCHEMBL7811397

O/N=C1\CN2CCC1CC2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 14/20 0.42
CHRM2 P08172 12/20 0.42
CHRM3 P20309 5/20 0.42
CHRNB2 P17787 3/20 0.41
CHRNA4 P43681 3/20 0.41
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34

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
SCHEMBL231365 1.00 CHRM1 (0.42) CHRM1CHRM2CHRM3CHRNB2CHRNA4
SCHEMBL231364 1.00 CHRM1 (0.42) CHRM1CHRM2CHRM3CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6169933 0.98 ALDH1A1 (0.43) CHRM1CHRM2CHRM3CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL7701666 0.98 ALDH1A1 (0.43) CHRM1CHRM2CHRM3CHRNB2CHRNA4
SCHEMBL14033267 0.92 CHRM1 (0.39) CHRM1CHRM2CHRM3CHRNB2CHRNA4
Carbamic Acid SCHEMBL7831823 0.88 ALDH1A1 (0.42) CHRM1CHRM2CHRM3CHRNB2CHRNA4
Carbamic Acid SCHEMBL7831819 0.88 ALDH1A1 (0.42) CHRM1CHRM2CHRM3CHRNB2CHRNA4
SCHEMBL14033833 0.86 CHRM2 (0.33) CHRM1CHRM2CHRM3CHRNB2CHRNA4
SCHEMBL7811134 0.86
SCHEMBL7818558 0.86

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
EP-0764165-B1 PREPARATION OF STEREOCHEMICALLY PURE OXIMES WITH MUSCARINIC ACTIVITY WARNER LAMBERT CO (US) 2001-11-07 EP disclosed