SCHEMBL7272297

SCHEMBL7272297

CN1CCC(Oc2noc(-c3ccccc3)c2Cl)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
SCN1A P35498 2/20 0.40
SCN2A Q99250 2/20 0.40
SCN3A Q9NY46 2/20 0.40
CHRM2 P08172 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2D6 P10635 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1A P35348 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
Hydrochloric Acid SCHEMBL7271450 0.99 SMN1; SMN2 (0.43) SMN1; SMN2SCN1ASCN2ASCN3ACHRM2
SCHEMBL7272158 0.88 CHRM2 (0.44) CHRM2CHRM1CHRM3CHRM4CHRM5
Hydrochloric Acid SCHEMBL7272809 0.87 CHRM2 (0.43) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL7272813 0.76 LRRK2 (0.39) SMN1; SMN2SCN1ASCN2ASCN3ACHRM2
Hydrochloric Acid SCHEMBL7280517 0.75 LRRK2 (0.39) SMN1; SMN2CHRM2CHRM1CHRM3CHRM4
SCHEMBL7272053 0.75 CHRM2 (0.42) CHRM2CHRM1CHRM3CHRM4CHRM5
Hydrochloric Acid SCHEMBL7272912 0.74 IKBKB (0.43) CHRM2CHRM1CHRM3HTR1ASLC6A2
Hydrochloric Acid SCHEMBL7272563 0.74 CHRM2 (0.41) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL7278648 0.73 ACHE (0.45) SMN1; SMN2CHRM2CHRM1CHRM3CHRM4
SCHEMBL7281975 0.73 SLC5A7 (0.37) HRH3LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643923-A TREATMENT OF ANXIETY, COGNITION ACTIVATORS, SENILITY OR ALZHEIMER'S SANKYO COMPANY, LIMITED (JP) 1997-07-01 US disclosed
EP-0456519-B1 Piperidyloxy- and quinuclidinyloxy- isoxazole derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1994-07-13 EP disclosed
EP-0456519-A1 Piperidyloxy- and quinuclidinyloxy- isoxazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1991-11-13 EP disclosed