SCHEMBL21979683

SCHEMBL21979683

OB(O)c1c(F)ccc2c1OCO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.36
CYP3A4 P08684 1/20 0.34
TXNRD1 Q16881 1/20 0.34
TXNRD3 Q86VQ6 1/20 0.34
TXNRD2 Q9NNW7 1/20 0.34
NPC1 O15118 6/20 0.34
RAB9A P51151 6/20 0.34
LMNA P02545 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
P4HB P07237 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
HTT P42858 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
PTGS2 P35354 1/20 0.32
TP53 P04637 2/20 0.32
CTNNB1 P35222 1/20 0.32

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
SCHEMBL28509833 0.85 CTNNB1 (0.35) NPC1RAB9AP4HBHTTTP53
SCHEMBL27192092 0.78 ACVRL1 (0.36) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL29950897 0.74 AOC3 (0.39) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL1224244 0.74 AOC3 (0.39) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL8798169 0.74 AOC3 (0.41) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL25166479 0.71 AOC3 (0.42) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL1172231 0.71 TXNRD1 (0.37) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL30049221 0.71 AOC3 (0.42) AOC3CYP3A4TXNRD1TXNRD3TXNRD2
SCHEMBL12865269 0.71 NQO2 (0.40) AOC3TXNRD1TXNRD3TXNRD2NPC1
SCHEMBL28506707 0.71 TXNRD1 (0.37) AOC3CYP3A4TXNRD1TXNRD3TXNRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12264159-B2 Functionalized heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2025-04-01 US disclosed
US-20240262828-A1 Functionalized Heterocycles as Antiviral Agents ENANTA PHARM INC (US) 2024-08-08 US disclosed
US-11891393-B2 Functionalized heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-02-06 US disclosed
US-20230075366-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARM INC (US) 2023-03-09 US disclosed
US-11198693-B2 Functionalized heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-12-14 US disclosed
EP-3883570-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS Enanta Pharmaceuticals, Inc. (US) 2021-09-29 EP disclosed
US-20200165249-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2020-05-28 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 (6 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-20240262828-A1 Functionalized Heterocycles as Antiviral Agents HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885
US-11891393-B2 Functionalized heterocycles as antiviral agents HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885
US-20230075366-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885
US-11198693-B2 Functionalized heterocycles as antiviral agents HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885
US-12264159-B2 Functionalized heterocycles as antiviral agents HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885
US-20200165249-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HAVCR2, HDGF AOC3 3664/4885CYP3A4 109/4885TXNRD1 1875/4885

“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.