SCHEMBL6927609

SCHEMBL6927609

O=C1N(CCCCN2CCC(c3ccccc3OS(=O)(=O)C(F)(F)F)CC2)CCN1c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.49
DRD3 P35462 10/20 0.49
DRD1 P21728 2/20 0.49
DRD4 P21917 2/20 0.49
DRD5 P21918 2/20 0.49
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
KCNH2 Q12809 6/20 0.40
CYP1A1 P04798 3/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL6923214 0.84 DRD2 (0.47) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL6928838 0.82 DRD2 (0.48) DRD2DRD3HTR1AHTR7KCNH2
SCHEMBL6928842 0.81 DRD2 (0.47) DRD2DRD3HTR1AHTR7KCNH2
SCHEMBL21590355 0.73 DRD2 (0.64) DRD2DRD3DRD1DRD4DRD5
SCHEMBL22444937 0.71 DRD2 (0.60) DRD2DRD3DRD1DRD4DRD5
SCHEMBL6925552 0.70 DRD2 (0.50) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL2783496 0.70 DRD2 (0.64) DRD2DRD3DRD1DRD4DRD5
SCHEMBL6220602 0.69 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL4096013 0.69 DRD2 (0.64) DRD2DRD3DRD1DRD4DRD5
SCHEMBL6223873 0.69 DRD2 (0.59) DRD2DRD3DRD4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030120070-A1 Serotonin 5-HT1A and dopamin D2 receptor ligands H. LUNDBECK A/S (DE) 2003-06-26 US disclosed
US-6514993-B1 Useful in the treatment of certain psychic and neurologic disorders H. LUNDBECK A/S (DK) 2003-02-04 US disclosed
EP-0770066-B1 SEROTONIN 5-HT 1A AND DOPAMIN D2 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2000-05-17 EP disclosed
EP-0770066-A1 SEROTONIN 5-HT 1A AND DOPAMIN D2 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 1997-05-02 EP disclosed
WO-1995033729-A1 SEROTONIN 5-HT1A AND DOPAMIN D2 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 1995-12-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030120070-A1 Serotonin 5-HT1A and dopamin D2 receptor ligands HTR5A, HTR2C, HTR1D DRD2 7/4885DRD3 17/4885DRD1 16/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.