SCHEMBL5532059

SCHEMBL5532059

CC(C)(C)CN1CCC(Oc2cc(F)nc3c(C(F)(F)F)cccc23)CC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.39
SCN8A Q9UQD0 1/20 0.39
KCNH2 Q12809 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SLC2A1 P11166 1/20 0.38
POLB P06746 2/20 0.38
RBP4 P02753 1/20 0.38
TTR P02766 1/20 0.38
SOS1 Q07889 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SCD O00767 7/20 0.37
PDE10A Q9Y233 1/20 0.37

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
SCHEMBL5530548 0.88 SCN1A (0.39) SCN1ASCN8AKCNH2HRH3POLB
SCHEMBL5532983 0.88 GRM2 (0.41) SCN1ASCN8AKCNH2HRH3SLC2A1
SCHEMBL8236599 0.87 POLB (0.38) SCN1ASCN8APOLBL3MBTL1
SCHEMBL5529449 0.87 SOS1 (0.41) SCN1ASCN8AKCNH2HRH3SLC2A1
SCHEMBL5530620 0.86 KCNH2 (0.41) KCNH2HRH3SLC2A1RBP4TTR
SCHEMBL5530042 0.85 KCNH2 (0.40) SCN1ASCN8AKCNH2HRH3SLC2A1
SCHEMBL5527397 0.84 HRH3 (0.52) KCNH2HRH3SLC2A1RBP4TTR
SCHEMBL5527506 0.83 NCF1 (0.43) SLC2A1POLBRBP4SCD
SCHEMBL5529852 0.83 HRH3 (0.40) KCNH2HRH3SLC2A1RBP4TTR
SCHEMBL14448782 0.80 TTR (0.41) KCNH2HRH3RBP4TTRSCD

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-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 SCN1A 89/4885SCN8A 103/4885KCNH2 10/4885

“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.