SCHEMBL6926959

SCHEMBL6926959

O=C1N(CCCCN2CCN(c3ccccc3OC3CCCC3)CC2)CCN1C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HTR1A P08908 2/20 0.47
HTR7 P34969 2/20 0.47
DRD2 P14416 2/20 0.46
ADRA1A P35348 2/20 0.46
DRD3 P35462 2/20 0.46

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
SCHEMBL6926353 0.86 ADRA1A (0.51) HTR1ADRD2ADRA1A
SCHEMBL6926357 0.85 DRD2 (0.52) HTR1ADRD2DRD3
SCHEMBL6926540 0.83 MEN1 (0.45) MEN1KMT2AHTR1AHTR7DRD2
SCHEMBL6927068 0.83 DRD2 (0.41) MEN1KMT2AHTR7DRD2
SCHEMBL6925552 0.82 DRD2 (0.50) MEN1KMT2AHTR1AHTR7DRD2
SCHEMBL5592219 0.77 HTR7 (0.64) MEN1KMT2AHTR1AHTR7DRD2
SCHEMBL8148403 0.77 HTR1A (0.57) HTR1ADRD2
Hydrochloric Acid SCHEMBL5592239 0.76 HTR7 (0.62) MEN1KMT2AHTR1AHTR7DRD2
SCHEMBL4522960 0.76 HTR1A (0.61) MEN1KMT2AHTR1AHTR7DRD2
SCHEMBL5424281 0.75 HTR1A (0.56) MEN1KMT2AHTR1AHTR7DRD2

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 3 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

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 MEN1 3854/4885KMT2A 2068/4885HTR1A 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.