SCHEMBL23717291

SCHEMBL23717291

N[C@@]1(C(F)(F)F)COc2c1cc([C@@](O)(CNC(=O)c1cc(F)c3ncsc3c1)C1CC1)nc2-c1ccc(F)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.31
GABRA5 P31644 2/20 0.31
CFTR P13569 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
SCHEMBL23717292 1.00 IRAK4 (0.31) IRAK4GABRA5CFTR
SCHEMBL23717303 0.92 CFTR (0.31) GABRA5CFTR
SCHEMBL23717296 0.92 CFTR (0.31) GABRA5CFTR
SCHEMBL23674634 0.89 CFTR (0.32) CFTR
SCHEMBL23674635 0.89 CFTR (0.32) CFTR
SCHEMBL23674633 0.89 CFTR (0.32) CFTR
SCHEMBL23717067 0.87 CFTR (0.30) GABRA5CFTR
SCHEMBL23717069 0.87 CFTR (0.30) GABRA5CFTR
SCHEMBL23717569 0.85 GABRA5 (0.33) GABRA5CFTR
SCHEMBL23717329 0.85 GABRA5 (0.33) GABRA5CFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11420976-B2 Heterocyclic compounds as anti-viral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-08-23 US disclosed
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2021-08-05 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 (2 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-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN IRAK4 2872/4885GABRA5 3187/4885CFTR 307/4885
US-11420976-B2 Heterocyclic compounds as anti-viral agents VIP, ACE, FURIN IRAK4 2872/4885GABRA5 3187/4885CFTR 307/4885

“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.