SCHEMBL6483129

SCHEMBL6483129

CN[C@@H]1Cc2cccc3ncn(c23)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 1.00
DRD3 P35462 13/20 1.00
HTR1A P08908 3/20 0.55
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CYP2D6 P10635 1/20 0.36
DRD4 P21917 1/20 0.35
PARP1 P09874 1/20 0.34
SIGMAR1 Q99720 1/20 0.33

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
Fumaric Acid SCHEMBL2965270 0.89 DRD2 (0.79) DRD2DRD3HTR1A
SCHEMBL6356040 0.82 DRD2 (0.70) DRD2DRD3HTR1ADRD4SIGMAR1
SCHEMBL7344010 0.79 DRD2 (0.65) DRD2DRD3HTR1A
SCHEMBL7376178 0.77 DRD2 (0.62) DRD2DRD3HTR1ASLC6A2SLC6A4
SCHEMBL7343813 0.77 DRD2 (1.00) DRD2DRD3HTR1ASLC6A2SLC6A4
SCHEMBL3222580 0.77 DRD2 (1.00) DRD2DRD3HTR1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7343645 0.76 DRD2 (0.61) DRD2DRD3HTR1ASLC6A2SLC6A4
SCHEMBL7348495 0.73 DRD2 (0.58) DRD2DRD3HTR1APARP1
SCHEMBL23261645 0.73 DRD2 (0.57) DRD2DRD3HTR1ASLC6A2SLC6A4
SCHEMBL31649518 0.73 DRD2 (0.57) DRD2DRD3HTR1ASLC6A2SLC6A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107378-A1 Heterocyclic amines having central nervous system activity ROMERO ARTHUR G (US) 2005-05-19 US disclosed
WO-2004108120-A1 USE OF GROWTH HORMONE SECRETAGOGUES FOR TREATMENT OF FIBROMYALGIA PFIZER PRODUCTS INC. (US) 2004-12-16 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-20050107378-A1 Heterocyclic amines having central nervous system activity CNR1, CNR2, NPY2R DRD2 59/4885DRD3 48/4885HTR1A 29/4885

“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.