SCHEMBL8320244

SCHEMBL8320244

[CH2]C1CCN(Cc2ccc(OC)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.63
SMN1; SMN2 Q16637 1/20 0.61
ACHE P22303 2/20 0.60
BACE1 P56817 1/20 0.60
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
PTGIR P43119 1/20 0.56
CHKA P35790 1/20 0.56
HRH3 Q9Y5N1 1/20 0.53

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
SCHEMBL8320248 0.85 HRH3 (0.69) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
SCHEMBL1043952 0.84 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2PTGIRCHKA
SCHEMBL20804352 0.84 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2PTGIRCHKA
SCHEMBL19285228 0.84 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2PTGIRCHKA
SCHEMBL8101249 0.83 SIGMAR1 (0.63) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
SCHEMBL2390775 0.83 MEN1 (0.68) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
SCHEMBL1586714 0.83 SIGMAR1 (0.63) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
SCHEMBL10868711 0.83 SIGMAR1 (0.63) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
Hydrochloric Acid SCHEMBL11534460 0.82 SIGMAR1 (0.61) SIGMAR1SMN1; SMN2ACHEBACE1MEN1
SCHEMBL22829113 0.81 SIGMAR1 (0.68) SIGMAR1ACHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3484879-B1 HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2020-12-30 EP claimed
EP-3484879-B1 HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2020-12-30 EP disclosed
EP-0604494-B1 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-07-28 EP disclosed
CN-1040436-C Pharmaceuticals SMITHKLINE BEECHAM PLC (GB) 1998-10-28 CN disclosed
CN-1073173-A Preparation method as the compound of 5-hydroxytryptamine receptor antagonist SMITHKLINE BEECHAM PLC (GB) 1993-06-16 CN disclosed