SCHEMBL6928842

SCHEMBL6928842

CCCOc1ccccc1C1CCN(CCCCN2CCN(c3ccc(F)cc3)C2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.47
DRD3 P35462 2/20 0.47
HTR1A P08908 2/20 0.45
HTR7 P34969 2/20 0.45
HRH2 P25021 1/20 0.41
ADRA1D P25100 1/20 0.41
HTR2A P28223 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTR6 P50406 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A1 P04798 2/20 0.41
KCNH2 Q12809 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL6926645 0.86 DRD2 (0.56) DRD2HTR1AHTR7HRH2HTR2A
SCHEMBL6928838 0.86 DRD2 (0.48) DRD2DRD3HTR1AHTR7RAB9A
SCHEMBL6926651 0.84 DRD2 (0.55) DRD2DRD3HTR1AHTR7HRH2
SCHEMBL6927609 0.81 DRD2 (0.49) DRD2DRD3HTR1AHTR7RAB9A
SCHEMBL6922568 0.80 DRD2 (0.47) DRD2HTR1AHTR7ADRA1DHTR2A
SCHEMBL6924581 0.79 DRD2 (0.46) DRD2HTR1AHTR7
SCHEMBL6928545 0.78 DRD2 (0.42) DRD2DRD3HTR1AHTR7HTR2A
SCHEMBL6928925 0.78 DRD2 (0.47) DRD2HTR1AHTR7HRH2ADRA1D
SCHEMBL6927072 0.78 DRD2 (0.44) DRD2HRH2
SCHEMBL6928609 0.76 PER2 (0.43) DRD2DRD3HTR1AHTR7HRH2

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 17/4885HTR1A 5/4885

“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.