SCHEMBL5529926

SCHEMBL5529926

FC(F)(F)c1cccc2c(OC3CCN(CC4CC4)CC3)ccnc12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.44
GRM2 Q14416 1/20 0.43
SCD O00767 5/20 0.43
AR P10275 7/20 0.42
SLC2A1 P11166 1/20 0.42
OPRK1 P41145 1/20 0.39
PDE10A Q9Y233 1/20 0.39
HRH1 P35367 1/20 0.38
CCR3 P51677 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
SCHEMBL5527453 0.96 NCF1 (0.41) NCF1GRM2SCDARSLC2A1
SCHEMBL5527506 0.88 NCF1 (0.43) NCF1SCDARSLC2A1
SCHEMBL5532313 0.87 NCF1 (0.42) NCF1SCDARSLC2A1
SCHEMBL5529425 0.85 AR (0.41) AROPRK1HRH1CCR3
SCHEMBL5521993 0.84 NCF1 (0.46) NCF1SCDARSLC2A1PDE10A
SCHEMBL5532330 0.84 HRH3 (0.48) NCF1SCDARSLC2A1
SCHEMBL5532983 0.84 GRM2 (0.41) GRM2SCDSLC2A1OPRK1PDE10A
SCHEMBL5528104 0.83 HRH3 (0.45) NCF1SCDARSLC2A1
SCHEMBL5535920 0.81 OPRL1 (0.43) AROPRK1HRH1CCR3
SCHEMBL8235826 0.80 OPRL1 (0.41) AROPRK1

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 NCF1 2805/4885GRM2 207/4885SCD 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.