SCHEMBL24988172

SCHEMBL24988172

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(C)C(=O)C(C)(C)O)C2CC2)cc2cn(C)nc12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.31
CSNK1E P49674 2/20 0.31
TTK P33981 1/20 0.31
BTK Q06187 1/20 0.30
IRAK1 P51617 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL24986542 0.93 CFTR (0.33) CSNK1DCSNK1ETTKIRAK1IRAK4
SCHEMBL24986543 0.93 CFTR (0.33) CSNK1DCSNK1ETTKIRAK1IRAK4
SCHEMBL24986157 0.90 CFTR (0.32) CSNK1DCSNK1EIRAK1IRAK4
SCHEMBL24345307 0.88 GABRA5 (0.31) CSNK1DCSNK1ETTK
SCHEMBL23700477 0.88 GABRA5 (0.33) CSNK1DCSNK1EIRAK1IRAK4
SCHEMBL23700479 0.88 GABRA5 (0.33) CSNK1DCSNK1EIRAK1IRAK4
SCHEMBL23700478 0.88 GABRA5 (0.33) CSNK1DCSNK1EIRAK1IRAK4
SCHEMBL24345475 0.86 CSNK1D (0.30) CSNK1DCSNK1E
SCHEMBL24345465 0.86 GABRA5 (0.31) CSNK1DCSNK1ETTK
SCHEMBL25114811 0.86 IRAK4 (0.36) CSNK1DCSNK1EIRAK1IRAK4

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-11572367-B2 Antiviral heterocyclic compounds ENANTA PHARMACEUTICALS, INC. (US) 2023-02-07 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-11572367-B2 Antiviral heterocyclic compounds ACE, HPRT1, ACE2 CSNK1D 3667/4885CSNK1E 2807/4885TTK 4388/4885

“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.