SCHEMBL5533005

SCHEMBL5533005

Fc1cc(OC2CCN(C(F)c3ccccc3)CC2)c2cccc(C(F)(F)F)c2n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.41
RBP4 P02753 1/20 0.41
SCD O00767 5/20 0.41
SCN1A P35498 3/20 0.39
SCN8A Q9UQD0 3/20 0.39
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
SOS1 Q07889 1/20 0.38
PDE10A Q9Y233 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MCHR1 Q99705 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
SCHEMBL5523125 0.91 SCN8A (0.46) TTRRBP4SCN1ASCN8A
SCHEMBL5530556 0.90 TTR (0.40) TTRRBP4SCDSCN1ASCN8A
SCHEMBL5531991 0.88 SCN8A (0.42) SCN1ASCN8AKCNH2HRH3KDM4E
SCHEMBL5529852 0.88 HRH3 (0.40) TTRRBP4SCDKCNH2HRH3
SCHEMBL8236177 0.84 SCN8A (0.38) SCN1ASCN8AKCNH2MCHR1
SCHEMBL5530874 0.84 SCD (0.43) TTRRBP4SCDKDM4ELMNA
SCHEMBL5527397 0.82 HRH3 (0.52) TTRRBP4SCDKCNH2HRH3
SCHEMBL5530620 0.82 KCNH2 (0.41) TTRRBP4SCDKCNH2HRH3
SCHEMBL14448782 0.81 TTR (0.41) TTRRBP4SCDKCNH2HRH3
SCHEMBL5529449 0.81 SOS1 (0.41) TTRRBP4SCDSCN1ASCN8A

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 TTR 3386/4885RBP4 4160/4885SCD 1710/4885

“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.