SCHEMBL6928221

SCHEMBL6928221

CC(C)C(Oc1ccccc1C1CCN(CCCCN2CCN(C3CCCCC3)C2=O)CC1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
PER2 O15055 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CACNA1G O43497 1/20 0.38
KCNH2 Q12809 1/20 0.38
SIGMAR1 Q99720 3/20 0.36
ADRA1D P25100 1/20 0.35

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 0.92 DRD2 (0.42) DRD2PER2MEN1KMT2ACACNA1G
SCHEMBL6924575 0.91 DRD2 (0.42) DRD2PER2MEN1KMT2ACACNA1G
SCHEMBL6928917 0.90 DRD2 (0.42) DRD2PER2MEN1KMT2ACACNA1G
SCHEMBL6927068 0.84 DRD2 (0.41) DRD2PER2MEN1KMT2AADRA1D
SCHEMBL6922568 0.84 DRD2 (0.47) DRD2MEN1KMT2AADRA1D
SCHEMBL6928224 0.84 PRMT5 (0.39) DRD2PER2MEN1KMT2ACACNA1G
SCHEMBL6924581 0.83 DRD2 (0.46) DRD2MEN1KMT2A
SCHEMBL6923216 0.83 DRD2 (0.41) DRD2PER2MEN1KMT2ACACNA1G
SCHEMBL6926295 0.83 PTGDR2 (0.41) DRD2PER2MEN1KMT2AADRA1D
SCHEMBL6928602 0.83 PER2 (0.46) DRD2PER2ADRA1D

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 7/4885PER2 1532/4885MEN1 3854/4885

“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.