SCHEMBL23502571

SCHEMBL23502571

CCCCCCCC(C)(CCCCC)c1cnc2cc(C(C)(CCCCC)CCCCCC)cc(F)c2n1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 2/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ TLR8 Q9NR97 2/20 0.30
▸ GRIN2B Q13224 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
SCHEMBL20047686 0.92 CNR2 (0.34) CNR2TLR8GRIN2B
SCHEMBL23502591 0.91 — —
SCHEMBL20047619 0.88 CNR2 (0.32) CNR2
SCHEMBL20047627 0.86 TLR8 (0.32) TLR8GRIN2B
SCHEMBL23502592 0.82 CNR2 (0.41) CNR2
SCHEMBL20047602 0.79 CNR2 (0.33) CNR2TLR8
SCHEMBL23502576 0.77 — —
SCHEMBL23502551 0.76 CNR2 (0.38) CNR2
SCHEMBL20047612 0.75 CNR2 (0.45) CNR2
SCHEMBL20047666 0.75 CNR2 (0.45) CNR2

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 TLR7 491/4885CNR2 485/4885TLR8 901/4885

“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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