SCHEMBL5528119

SCHEMBL5528119

Cc1cc(OC2CCN(CC(C)(C)C)CC2)c2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 3/20 0.44
HCRTR1 O43613 1/20 0.43
HCRTR2 O43614 1/20 0.43
HTR1D P28221 4/20 0.42
HRH3 Q9Y5N1 3/20 0.42
TLR9 Q9NR96 1/20 0.42
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
HTR1A P08908 2/20 0.41
HTR1B P28222 2/20 0.41
NCF1 P14598 2/20 0.40
S1PR5 Q9H228 1/20 0.40
RBP4 P02753 1/20 0.39
TTR P02766 1/20 0.39
POLB P06746 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
SCHEMBL5532160 0.85 HTR1D (0.44) HCRTR1HCRTR2HTR1DHRH3TLR9
SCHEMBL5532963 0.85 NCF1 (0.58) HTR1DHRH3HTR1AHTR1BNCF1
SCHEMBL5532322 0.84 SLC2A1 (0.45) ADAM17HCRTR1HCRTR2HTR1DHRH3
SCHEMBL5537578 0.83 HTR1A (0.53) ADAM17HTR1DHRH3HTR1AHTR1B
SCHEMBL5527371 0.83 HTR1D (0.49) ADAM17HCRTR1HCRTR2HTR1DHRH3
SCHEMBL5528217 0.83 HRH3 (0.52) HCRTR1HCRTR2HRH3HTR1ANCF1
SCHEMBL14437441 0.81 NCF1 (0.51) ADAM17HTR1DTLR9TLR8TLR7
SCHEMBL5529815 0.81 NCF1 (0.51) HTR1DHTR1AHTR1BNCF1
SCHEMBL5532956 0.81 MCHR1 (0.53) HCRTR1HCRTR2HTR1DHTR1AHTR1B
SCHEMBL5529129 0.80 HTR1D (0.52) HTR1DHTR1AHTR1BNCF1

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-20070197509-A1 Compositions and methods for modulating gated ion channels PAINCEPTOR PHARMA CORPORATION (CA) 2007-08-23 US disclosed
US-20070197509-A1 Compositions and methods for modulating gated ion channels PAINCEPTOR PHARMA CORPORATION (CA) 2007-08-23 US disclosed
US-20070197509-A1 Compositions and methods for modulating gated ion channels PAINCEPTOR PHARMA CORPORATION (CA) 2007-08-23 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-20070197509-A1 Compositions and methods for modulating gated ion channels KCNN3, KCNN2, HCN3 ADAM17 3125/4885HCRTR1 887/4885HCRTR2 374/4885

“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.