SCHEMBL3201459

SCHEMBL3201459

CN(C)CCc1cn(S(=O)(=O)c2ccc3c(c2)N(C)CCO3)c2cccnc12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.45
NPC1 O15118 1/20 0.43
PKM P14618 1/20 0.43
PKLR P30613 1/20 0.43
RAB9A P51151 1/20 0.43
HTR1A P08908 2/20 0.42
DRD2 P14416 2/20 0.42
HTR1D P28221 2/20 0.42
HTR1B P28222 2/20 0.42
HTR1F P30939 2/20 0.42
HTR7 P34969 2/20 0.42
DRD3 P35462 2/20 0.42
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
HTR1E P28566 1/20 0.38

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
SCHEMBL3211779 0.94 HTR6 (0.44) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3191605 0.89 PKM (0.46) HTR6NPC1PKMPKLRRAB9A
SCHEMBL3205179 0.88 PKM (0.43) HTR6NPC1PKMPKLRRAB9A
SCHEMBL3212395 0.88 PKM (0.43) HTR6NPC1PKMPKLRRAB9A
SCHEMBL3211419 0.86 HTR6 (0.46) HTR6PKMHTR1ADRD2HTR1D
SCHEMBL3212422 0.84 HTR6 (0.46) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3215236 0.83 HTR6 (0.42) HTR6NPC1PKMPKLRRAB9A
SCHEMBL3193075 0.82 HTR6 (0.45) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL3194254 0.82 HTR6 (0.42) HTR6NPC1PKMPKLRRAB9A
SCHEMBL3203207 0.82 HTR6 (0.41) HTR6NPC1PKMPKLRRAB9A

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-20100029629-A1 ACYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US claimed
US-20100029629-A1 ACYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
US-20100029629-A1 ACYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
WO-2010011546-A2 ACYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-28 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-20100029629-A1 ACYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY HTR6, HTR1A, HTR5A HTR6 1/4885NPC1 2333/4885PKM 2104/4885

“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.