SCHEMBL3328910

SCHEMBL3328910

CCCN1CC(c2ccc3c(c2)CCN3S(=O)(=O)c2ccc(-c3cnco3)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 13/20 0.58
HRH3 Q9Y5N1 3/20 0.53
HTR6 P50406 9/20 0.49
DRD2 P14416 4/20 0.49
CYP11B1 P15538 5/20 0.39
CYP11B2 P19099 5/20 0.39
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
KDM1B Q8NB78 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
Hydrochloric Acid SCHEMBL3327343 0.99 DRD3 (0.58) DRD3HRH3HTR6DRD2CYP11B1
SCHEMBL3323067 0.85 HTR6 (0.52) DRD3HRH3HTR6CYP11B1CYP11B2
SCHEMBL3323159 0.81 DRD3 (0.86) DRD3HRH3HTR6DRD2KDM1A
Hydrochloric Acid SCHEMBL3323948 0.80 DRD3 (0.84) DRD3HRH3HTR6DRD2KDM1A
SCHEMBL3323319 0.78 HTR6 (0.43) HTR6
SCHEMBL1546199 0.74 KMT2A (0.58)
SCHEMBL1546425 0.71 KMT2A (0.53)
SCHEMBL1546423 0.71 KMT2A (0.53)
SCHEMBL1545895 0.67 POLB (0.47) DRD3HTR6DRD2
SCHEMBL1545893 0.67 POLB (0.47) DRD3HTR6DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507469-B2 Azetidin compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT GMBH & CO. KG (DE) 2013-08-13 US claimed
US-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-06-03 US claimed
US-8507469-B2 Azetidin compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT GMBH & CO. KG (DE) 2013-08-13 US disclosed
US-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-06-03 US 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-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR HTR6, HTR4, HTR3C DRD3 35/4885HRH3 110/4885HTR6 1/4885

“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.