SCHEMBL27290495

SCHEMBL27290495

CN1CCN2c3c(cccc31)C1CN(CCCCC(=O)c3ccc(F)cc3)CCC12

nearest known ligand 0.95

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 18/20 0.95
HTR2C P28335 15/20 0.95
SLC6A4 P31645 5/20 0.95
DRD2 P14416 1/20 0.95
HTR1A P08908 1/20 0.79
DRD1 P21728 1/20 0.79
DRD4 P21917 1/20 0.79
ADRA1A P35348 1/20 0.79
ADRA1B P35368 1/20 0.79
CCR3 P51677 1/20 0.71

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
SCHEMBL27288366 1.00 HTR2A (0.95) HTR2AHTR2CSLC6A4DRD2HTR1A
SCHEMBL27288363 0.99 HTR2A (0.93) HTR2AHTR2CSLC6A4DRD2HTR1A
SCHEMBL27290546 0.99 HTR2A (0.93) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL29355930 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL22067597 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL17681371 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL1468226 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL21524899 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL7996531 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A
Lumateperone SCHEMBL5513940 0.97 HTR2A (1.00) HTR2AHTR2CSLC6A4DRD2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024145659-A1 HETEROCYCLE FUSED GAMMA-CARBOLINES ACTING ON THE SEROTONINE 5-HT2A RECEPTOR INTRA-CELLULAR THERAPIES, INC. (US) 2024-07-04 WO disclosed