SCHEMBL6928602

SCHEMBL6928602

CC(C)Oc1ccc(F)cc1C1CCN(CCCCN2CCN(C3CCCCC3)C2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PER2 O15055 9/20 0.46
ADRA1D P25100 3/20 0.41
DRD2 P14416 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
PTGDR2 Q9Y5Y4 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
SCHEMBL6922567 0.90 DRD2 (0.42) PER2ADRA1DDRD2ADRA1AADRA1B
SCHEMBL6922897 0.89 PTGDR (0.39) PER2PTGDR2
SCHEMBL6924575 0.89 DRD2 (0.42) PER2ADRA1DDRD2ADRA1AADRA1B
SCHEMBL6928917 0.88 DRD2 (0.42) PER2ADRA1DDRD2ADRA1AADRA1B
SCHEMBL6928509 0.87 PTGDR2 (0.42) PER2DRD2PTGDR2
SCHEMBL6928609 0.87 PER2 (0.43) PER2ADRA1DDRD2ADRA1AADRA1B
SCHEMBL6929462 0.84 KCNH2 (0.40) PER2DRD2PTGDR2
SCHEMBL6928221 0.83 DRD2 (0.41) PER2ADRA1DDRD2
SCHEMBL6926353 0.78 ADRA1A (0.51) ADRA1DDRD2ADRA1AADRA1B
SCHEMBL6927068 0.76 DRD2 (0.41) PER2ADRA1DDRD2ADRA1BPTGDR2

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 PER2 1532/4885ADRA1D 67/4885DRD2 7/4885

“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.