SCHEMBL9355384

SCHEMBL9355384

CCCN(CCC)C1CCc2ccccc2C1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 1.00
MEN1 O00255 1/20 0.63
CYP1A2 P05177 1/20 0.63
HTR1A P08908 1/20 0.63
TSHR P16473 1/20 0.63
DRD4 P21917 1/20 0.63
DRD3 P35462 1/20 0.63
HTR5A P47898 1/20 0.63
KMT2A Q03164 1/20 0.63

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
SCHEMBL10585868 0.83 DRD2 (0.71) DRD2MEN1CYP1A2HTR1ATSHR
SCHEMBL9145254 0.83 DRD2 (0.71) DRD2MEN1CYP1A2HTR1ATSHR
Bromide SCHEMBL15662725 0.82 DRD2 (0.69) DRD2HTR1A
SCHEMBL10445855 0.81 DRD2 (0.68) DRD2HTR1A
SCHEMBL9308579 0.80 DRD2 (0.66) DRD2MEN1CYP1A2HTR1ATSHR
SCHEMBL9308578 0.80 DRD2 (0.66) DRD2MEN1CYP1A2HTR1ATSHR
SCHEMBL9018937 0.79 DRD2 (0.65) DRD2HTR1ADRD3
Bromide SCHEMBL9310041 0.79 DRD2 (0.64) DRD2MEN1CYP1A2HTR1ATSHR
Bromide SCHEMBL9310045 0.79 DRD2 (0.64) DRD2MEN1CYP1A2HTR1ATSHR
SCHEMBL29389256 0.77 DRD2 (1.00) DRD2MEN1CYP1A2HTR1ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0452390-B1 HALO SUBSTITUTED AMINOTETRALINS UPJOHN CO (US) 1994-10-26 EP disclosed
US-5225596-A Halo substituted aminotetralins THE UPJOHN COMPANY (US) 1993-07-06 US disclosed
US-5214156-A Central nervous system disorders, dopamime receptor activity THE UPJOHN COMPANY (US) 1993-05-25 US disclosed
EP-0334538-B1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1992-12-02 EP disclosed
EP-0407416-A1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1991-01-16 EP disclosed
WO-1990007490-A1 HALO SUBSTITUTED AMINOTETRALINS THE UPJOHN COMPANY (US) 1990-07-12 WO disclosed
WO-1989009050-A1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1989-10-05 WO disclosed