SCHEMBL8529199

SCHEMBL8529199

O=C(O)C(O)(c1ccccc1)c1ccc(I)cc1C1CN2CCC1CC2

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.47
CHRM1 P11229 5/20 0.47
CHRM3 P20309 5/20 0.47
CHRM4 P08173 1/20 0.47
CHRM5 P08912 1/20 0.47
LMNA P02545 1/20 0.42
CHRNA7 P36544 1/20 0.41

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
SCHEMBL5712869 0.86 CHRM2 (0.53) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL9145091 0.85 CHRM2 (0.46) CHRM2CHRM1CHRM3CHRM4CHRM5
Benzylic Acid SCHEMBL27924962 0.69 CHRM3 (0.51) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL8529194 0.69 CHRM2 (0.86) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL9145154 0.69 CHRM2 (0.86) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL9146124 0.69 CHRM2 (0.86) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL10817618 0.69 CHRM2 (0.86) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL9145694 0.67 CYP2C9 (0.64) LMNA
SCHEMBL9145687 0.67 CYP2C9 (0.64) LMNA
SCHEMBL4971345 0.66 CHRNA7 (0.56) CHRM2CHRM1CHRM3CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648130-B1 RADIOIODINATED BENZOVESAMICOL ANALOGS FOR CHOLINERGIC NERVE MAPPING UNIV MICHIGAN (US) 1998-12-30 EP disclosed
EP-0648130-A1 RADIOIODINATED BENZOVESAMICOL ANALOGS FOR CHOLINERGIC NERVE MAPPING THE UNIVERSITY OF MICHIGAN (US) 1995-04-19 EP disclosed
US-5387409-A Diagnostic imaging agents, e.g. hypoxic tissue; radiotherapy; kits BRACCO INTERNATIONAL B.V. (NL) 1995-02-07 US disclosed
EP-0648130-A4 RADIOIODINATED BENZOVESAMICOL ANALOGS FOR CHOLINERGIC NERVE MAPPING. UNIV MICHIGAN (US) 1994-01-26 EP disclosed
US-5077035-A Scintigraphic imaging of brain; Alzheimer*s diagnosis THE UNIVERSITY OF MICHIGAN (US) 1991-12-31 US disclosed
WO-1991017776-A1 RADIOIODINATED BENZOVESAMICOL ANALOGS FOR CHOLINERGIC NERVE MAPPING THE UNIVERSITY OF MICHIGAN (US) 1991-11-28 WO disclosed
EP-0441491-A1 Boronic acid adducts of rhenium dioxime and technetium-99M dioxime complexes containing a biochemically active group BRACCO INTERNATIONAL B.V. (NL) 1991-08-14 EP disclosed