SCHEMBL30855331

SCHEMBL30855331

CC(C)(C)OC(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1

nearest known ligand 0.85

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 20/20 0.85
DRD2 P14416 20/20 0.85
HTR2A P28223 20/20 0.85
DRD3 P35462 11/20 0.81

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
SCHEMBL15788650 1.00 HTR1A (0.85) HTR1ADRD2HTR2ADRD3
SCHEMBL17579942 1.00 HTR1A (0.85) HTR1ADRD2HTR2ADRD3
SCHEMBL17579944 1.00 HTR1A (0.85) HTR1ADRD2HTR2ADRD3
SCHEMBL22302323 0.93 HTR1A (0.73) HTR1ADRD2HTR2ADRD3
SCHEMBL22302300 0.92 HTR1A (0.71) HTR1ADRD2HTR2ADRD3
SCHEMBL17598625 0.92 HTR1A (1.00) HTR1ADRD2HTR2ADRD3
SCHEMBL19824708 0.92 HTR1A (1.00) HTR1ADRD2HTR2ADRD3
SCHEMBL17598631 0.92 HTR1A (1.00) HTR1ADRD2HTR2ADRD3
SCHEMBL17598649 0.89 HTR1A (1.00) HTR1ADRD2HTR2ADRD3
SCHEMBL19824743 0.89 HTR1A (1.00) HTR1ADRD2HTR2ADRD3

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-4594294-A1 DOPAMINE D3/D2 RECEPTOR PARTIAL AGONISTS FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS The United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2025-08-06 EP disclosed
WO-2024072930-A1 DOPAMINE D3/D2 RECEPTOR PARTIAL AGONISTS FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-04-04 WO disclosed