SCHEMBL30510686

SCHEMBL30510686

COc1cc(I)c(OC)c2c1CCC(N)C2

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 3/20 0.59
DRD2 P14416 2/20 0.47
DRD3 P35462 2/20 0.47
HTR2A P28223 3/20 0.39
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
HTR1A P08908 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
SCHEMBL25240402 1.00 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR1D
SCHEMBL30510684 1.00 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR1D
SCHEMBL25238565 0.94 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR1D
SCHEMBL30510677 0.86 ADRA1A (0.65) ADRA1ADRD2DRD3HTR1DHTR1B
SCHEMBL25246966 0.86 ADRA1A (0.65) ADRA1ADRD2DRD3HTR1DHTR1B
SCHEMBL7542030 0.85 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR2C
SCHEMBL30510676 0.85 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR2C
SCHEMBL25757249 0.83 ADRA1A (0.61) ADRA1ADRD2DRD3HTR2AHTR1D
SCHEMBL25284237 0.82 ADRA1A (0.59) ADRA1ADRD2DRD3HTR2AHTR1D
SCHEMBL25285673 0.80 ADRA1A (0.65) ADRA1ADRD2DRD3HTR1DHTR1B

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-4457203-A1 AMINOTETRALINE ACTIVATORS OF SEROTONIN RECEPTORS ATAI Therapeutics, Inc. (US) 2024-11-06 EP disclosed
WO-2023129909-A1 AMINOTETRALINE ACTIVATORS OF SEROTONIN RECEPTORS ATAI Life Sciences AG (DE) 2023-07-06 WO disclosed