SCHEMBL7286179

SCHEMBL7286179

CN(c1ccccc1O)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.53
OPRM1 P35372 3/20 0.51
SIGMAR1 Q99720 3/20 0.51
DRD2 P14416 3/20 0.51
HTR2A P28223 2/20 0.51
HTR2C P28335 2/20 0.51
HTR2B P41595 2/20 0.51
BCHE P06276 2/20 0.50
BACE1 P56817 2/20 0.50
GMNN O75496 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
HPGD P15428 1/20 0.49
DRD4 P21917 1/20 0.49
DRD3 P35462 1/20 0.49
PMP22 Q01453 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL21375648 0.81 SIGMAR1 (0.60) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL7139857 0.79 CHRM2 (0.48) ACHEOPRM1SIGMAR1HTR2ABCHE
SCHEMBL5859715 0.79 KDM4E (0.57) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL2108897 0.79 ACHE (0.66) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL8791969 0.78 DRD2 (0.67) ACHEOPRM1SIGMAR1DRD2HTR2A
Hydrochloric Acid SCHEMBL2976109 0.77 ACHE (0.64) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL28173289 0.77 ACHE (0.64) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL5570638 0.76 ACHE (0.62) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL19311894 0.76 ACHE (0.62) ACHEOPRM1SIGMAR1DRD2HTR2A
SCHEMBL784863 0.75 SIGMAR1 (0.68) ACHEOPRM1SIGMAR1DRD2HTR2A

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-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed