SCHEMBL5530620

SCHEMBL5530620

CC(C)(C)N1CCC(Oc2cc(F)nc3c(C(F)(F)F)cccc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
TTR P02766 2/20 0.40
RBP4 P02753 1/20 0.40
SCD O00767 9/20 0.39
PDE10A Q9Y233 1/20 0.39
SLC2A1 P11166 1/20 0.38
SOS1 Q07889 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL5528228 0.88 KCNH2 (0.38) KCNH2HRH3SCDPDE10AKDM4E
SCHEMBL5527397 0.87 HRH3 (0.52) KCNH2HRH3TTRRBP4SCD
SCHEMBL5532059 0.86 SCN1A (0.39) KCNH2HRH3TTRRBP4SCD
SCHEMBL5529852 0.86 HRH3 (0.40) KCNH2HRH3TTRRBP4SCD
SCHEMBL8231334 0.85 MAPK14 (0.35) KCNH2PDE10A
SCHEMBL5532983 0.84 GRM2 (0.41) KCNH2HRH3TTRRBP4SCD
SCHEMBL5529449 0.83 SOS1 (0.41) KCNH2HRH3TTRRBP4SCD
SCHEMBL14448782 0.83 TTR (0.41) KCNH2HRH3TTRRBP4SCD
SCHEMBL5533005 0.82 TTR (0.41) KCNH2HRH3TTRRBP4SCD
SCHEMBL5521993 0.82 NCF1 (0.46) KCNH2HRH3RBP4SCDPDE10A

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 KCNH2 10/4885HRH3 1454/4885TTR 3386/4885

“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.