SCHEMBL11263133

SCHEMBL11263133

CCN(C)C1CCc2c[nH]cc2C1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.55
DRD4 P21917 4/20 0.55
DRD3 P35462 4/20 0.55
HTR1D P28221 2/20 0.41
SIGMAR1 Q99720 1/20 0.40
HTR1A P08908 1/20 0.38
DRD1 P21728 1/20 0.38
FYN P06241 1/20 0.36
HTR1B P28222 1/20 0.36

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
SCHEMBL11489608 0.87 DRD2 (0.42) DRD2DRD4DRD3HTR1DSIGMAR1
SCHEMBL11268179 0.84 DRD2 (0.50) DRD2DRD4DRD3HTR1AFYN
SCHEMBL11269661 0.82 SIGMAR1 (0.42) DRD2DRD4DRD3HTR1DSIGMAR1
SCHEMBL11498936 0.80 DRD2 (0.37) DRD2DRD4DRD3HTR1DSIGMAR1
SCHEMBL11267287 0.78 HTR1A (0.64) DRD2DRD4DRD3HTR1DHTR1A
SCHEMBL12125968 0.77 DRD3 (0.65) DRD2DRD4DRD3HTR1A
Maleic Acid SCHEMBL11269870 0.74 ALDH1A1 (0.43) DRD2DRD4DRD3HTR1AFYN
Hydrochloric Acid SCHEMBL11207856 0.73 DRD2 (0.46) DRD2DRD4DRD3HTR1DSIGMAR1
SCHEMBL26297471 0.72 DRD2 (0.62) DRD2DRD4DRD3HTR1DSIGMAR1
SCHEMBL11266620 0.72 DRD2 (0.49) DRD2DRD4DRD3HTR1DHTR1A

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
EP-0014792-B1 TETRAHYDRO-2H-BENZO(C)PYRROLES, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THE COMPOUNDS FOR USE AS THERAPEUTICALS ELI LILLY AND COMPANY (US) 1982-12-01 EP disclosed
US-4264622-A TREATMENT OF PARKINSON*S DISEASE ELI LILLY AND COMPANY (US) 1981-04-28 US disclosed
US-4235776-A USED FOR TREATMENT OF PARKINSON'S DISEASE, PROLACTIN INHIBITORS, AND DOPAMINE AGONISTS ELI LILLY AND COMPANY (US) 1980-11-25 US disclosed