SCHEMBL10754236

SCHEMBL10754236

CCCN(CCC)C1CCc2nc(O)ncc2C1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.59
DRD3 P35462 12/20 0.59
FYN P06241 1/20 0.55
HTR1A P08908 6/20 0.51
DRD4 P21917 5/20 0.51
MEN1 O00255 2/20 0.51
ADRB2 P07550 2/20 0.51
CYP2D6 P10635 2/20 0.51
KMT2A Q03164 2/20 0.51
CASP1 P29466 1/20 0.51
HTR7 P34969 4/20 0.50
DRD1 P21728 2/20 0.50
HTR1D P28221 2/20 0.50
DRD5 P21918 1/20 0.50
CYP1A2 P05177 1/20 0.50
TSHR P16473 1/20 0.50
LMNA P02545 1/20 0.50
HTR1B P28222 1/20 0.50
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50

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 SCHEMBL10761212 0.99 DRD2 (0.57) DRD2DRD3FYNHTR1ADRD4
SCHEMBL10761230 0.84 DRD2 (0.66) DRD2DRD3FYNHTR1AHTR1D
SCHEMBL10758705 0.83 DRD3 (0.60) DRD2DRD3FYNHTR1ADRD4
SCHEMBL10761186 0.83 DRD2 (0.60) DRD2DRD3FYNHTR1A
Hydrochloric Acid SCHEMBL10763527 0.83 DRD2 (0.64) DRD2DRD3FYNHTR1AHTR1D
SCHEMBL10755730 0.82 DRD2 (0.62) DRD2DRD3FYNHTR1AHTR1D
SCHEMBL10762873 0.82 DRD2 (0.56) DRD2DRD3FYNHTR1ADRD4
Hydrochloric Acid SCHEMBL10850176 0.81 DRD2 (0.61) DRD2DRD3FYNHTR1A
Bromide SCHEMBL10759133 0.81 DRD2 (0.55) DRD2DRD3FYNHTR1AMEN1
SCHEMBL10762864 0.81 DRD3 (0.55) DRD2DRD3FYNHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0209983-A1 Dialkylaminotetrahydroquinazoline ELI LILLY AND COMPANY (US) 1987-01-28 EP disclosed
US-4622398-A INCREASING CONCENTRATION OF DOPAMINE AND NOREPINEPHRINE IN BRAIN, ANTAGONIST ELI LILLY AND COMPANY (US) 1986-11-11 US disclosed