SCHEMBL24946129

SCHEMBL24946129

C[C@@H](Oc1ccc(-c2cnc(N)cn2)cn1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 15/20 0.41
ALOX5AP P20292 14/20 0.41
TLR9 Q9NR96 1/20 0.39
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
GPR88 Q9GZN0 2/20 0.38
PIK3CD O00329 1/20 0.38
PDGFRA P16234 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 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
SCHEMBL24946644 0.90 ALOX5AP (0.40) FEN1ALOX5AP
SCHEMBL24946518 0.86 FEN1 (0.40) FEN1ALOX5AP
SCHEMBL23116071 0.85 PIK3CD (0.38) FEN1ALOX5APGPR88PIK3CDPDGFRA
SCHEMBL23116111 0.85 PIK3CD (0.38) FEN1ALOX5APGPR88PIK3CDPDGFRA
SCHEMBL23116070 0.85 PIK3CD (0.38) FEN1ALOX5APGPR88PIK3CDPDGFRA
SCHEMBL23116237 0.85 GPR88 (0.39) GPR88PIK3CDPDGFRAPIK3CAPIK3CB
SCHEMBL23116240 0.85 GPR88 (0.39) GPR88PIK3CDPDGFRAPIK3CAPIK3CB
SCHEMBL29972319 0.85 GPR88 (0.39) GPR88PIK3CDPDGFRAPIK3CAPIK3CB
SCHEMBL23116234 0.85 GPR88 (0.39) GPR88PIK3CDPDGFRAPIK3CAPIK3CB
SCHEMBL24946641 0.83 FEN1 (0.40) FEN1ALOX5AP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230034917-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. 2023-02-02 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-20230034917-A1 ION CHANNEL MODULATORS SCN1A, SCN3A, SCN2A FEN1 4819/4885ALOX5AP 1210/4885TLR9 4869/4885

“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.