SCHEMBL6928660

SCHEMBL6928660

CCCOc1ccccc1C1=CCN(CCCCn2ccn(C34CC5CC(CC(C5)C3)C4)c2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.38
CNR2 P34972 2/20 0.37
DRD2 P14416 5/20 0.36
HTR6 P50406 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
HTR7 P34969 3/20 0.36
EPHX2 P34913 2/20 0.35
CACNA1G O43497 1/20 0.35
KCNH2 Q12809 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HTR1A P08908 2/20 0.34
SLC6A4 P31645 2/20 0.34
DRD4 P21917 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34

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
SCHEMBL6928656 0.88 PARP1 (0.39) PARP1DRD2HTR6PPARGPPARA
Oxalic Acid SCHEMBL6925423 0.84 CACNA1G (0.39) PARP1DRD2HTR6PPARGPPARA
SCHEMBL6930016 0.80 PARP1 (0.39) PARP1DRD2HTR6PPARGPPARA
SCHEMBL6928738 0.80 DRD2 (0.43) DRD2HTR7EPHX2ALDH1A1MEN1
SCHEMBL6928645 0.71 PARP1 (0.40) PARP1DRD2HTR6PPARGPPARA
SCHEMBL6928545 0.69 DRD2 (0.42) PARP1DRD2HTR6PPARGPPARA
SCHEMBL6929163 0.68 DRD2 (0.52) DRD2HTR6PPARGPPARAMEN1
SCHEMBL6930008 0.67 PARP1 (0.40) PARP1DRD2HTR6PPARGPPARA
SCHEMBL14761735 0.67 DRD2 (0.57) DRD2HTR6HTR7HTR1ASLC6A4
SCHEMBL11823780 0.66 PARP1 (0.46) PARP1DRD2HTR6PPARGPPARA

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 PARP1 2749/4885CNR2 34/4885DRD2 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.