SCHEMBL7282289

SCHEMBL7282289

CN1CCC(Oc2noc3ccc(F)cc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 3/20 0.44
HTR1A P08908 1/20 0.43
TDO2 P48775 1/20 0.43
HTR3A P46098 2/20 0.43
KMT2A Q03164 1/20 0.41
DRD2 P14416 1/20 0.40
SLC6A4 P31645 1/20 0.40
SCD O00767 3/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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 SCHEMBL7279867 0.99 HTR1F (0.43) HTR1FHTR1ATDO2HTR3AKMT2A
SCHEMBL7271454 0.86 HTR2C (0.44) HTR1ADRD2MAOAMAOB
Hydrochloric Acid SCHEMBL7272664 0.85 HTR2C (0.43) HTR1ADRD2MAOAMAOB
SCHEMBL7281834 0.85 MAOA (0.44) HTR1AHTR3AMAOAMAOB
SCHEMBL7271094 0.85 FAAH (0.47) HTR3AMAOAMAOB
Hydrochloric Acid SCHEMBL7271028 0.84 FAAH (0.46) HTR3AMAOAMAOB
Hydrochloric Acid SCHEMBL7282305 0.84 MAOA (0.44) HTR1AHTR3AMAOAMAOB
SCHEMBL7278648 0.81 ACHE (0.45) HTR1AHTR3AMAOAMAOB
Hydrochloric Acid SCHEMBL7280360 0.80 ACHE (0.44) HTR1AHTR3AKMT2AMAOAMAOB
SCHEMBL7282325 0.77 ALDH1A1 (0.47) HTR3AKMT2AMAOAMAOB

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