SCHEMBL26545532

SCHEMBL26545532

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OCC3(F)C(N)=O)C(F)(F)F)cc2cc(Cl)c(C)nc12

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.32
GABRA5 P31644 1/20 0.31
POLB P06746 1/20 0.30
KMT2A Q03164 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
SCHEMBL25114685 0.92 CFTR (0.32) CFTRGABRA5POLBKMT2A
SCHEMBL25114434 0.92 CFTR (0.33) CFTRGABRA5
SCHEMBL25114583 0.92 CFTR (0.33) CFTRGABRA5
SCHEMBL25114579 0.92 CFTR (0.33) CFTRGABRA5
SCHEMBL25114340 0.91 CFTR (0.32) CFTRGABRA5
SCHEMBL25114568 0.91 CFTR (0.32) CFTRGABRA5
SCHEMBL25114563 0.91 CFTR (0.32) CFTRGABRA5
SCHEMBL25115350 0.91 CFTR (0.31) CFTR
SCHEMBL25114618 0.91 CFTR (0.31) CFTR
SCHEMBL25114619 0.91 CFTR (0.31) CFTR

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-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 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-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ACE, HPRT1, ACE2 CFTR 283/4885GABRA5 3773/4885POLB 2743/4885

“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.