SCHEMBL23502473

SCHEMBL23502473

CCCCCCCC(C)(CCCC)c1nc2c(C(C)(C)C)cccc2nc1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 5/20 0.33
▸ KCNH2 Q12809 4/20 0.32
▸ TLR7 Q9NYK1 4/20 0.32
▸ NR1H2 P55055 2/20 0.31
▸ NR1H3 Q13133 1/20 0.31
▸ EPHX2 P34913 1/20 0.30

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
SCHEMBL20047581 0.85 TLR8 (0.32) TLR8KCNH2TLR7NR1H2NR1H3
SCHEMBL20047554 0.79 GAA (0.38) NR1H2NR1H3
SCHEMBL20047580 0.79 GAA (0.38) NR1H2NR1H3
SCHEMBL23502449 0.77 NR1H2 (0.33) NR1H2NR1H3
SCHEMBL20047490 0.76 NR1H2 (0.35) NR1H2NR1H3
SCHEMBL23502475 0.73 TLR8 (0.33) TLR8KCNH2TLR7
SCHEMBL23502460 0.73 TLR8 (0.35) TLR8KCNH2TLR7
SCHEMBL23502452 0.71 TLR8 (0.34) TLR8TLR7
SCHEMBL20989986 0.71 CA2 (0.40) NR1H2
SCHEMBL20047567 0.71 CNR2 (0.35) TLR8KCNH2TLR7

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-11034684-B2 Isoxazole analogs as FXR agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2021-06-15 — — 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-11034684-B2 Isoxazole analogs as FXR agonists and methods of use thereof GPBAR1, SLC10A1, NR1H4 TLR8 901/4885KCNH2 4528/4885TLR7 491/4885

“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.

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