SCHEMBL21175739

SCHEMBL21175739

COCCCOc1cc(C2COC(C)(C)C2NC=O)ccc1Br

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
SLC6A4 P31645 1/20 0.33
USP2 O75604 1/20 0.33
REN P00797 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL19252780 0.89 PDE4A (0.36) REN
SCHEMBL21175956 0.82 SLC6A4 (0.37) KDM4ESLC6A4USP2RENALDH1A1
SCHEMBL21175808 0.81 SLC6A4 (0.36) SLC6A4RENALDH1A1KMT2AMEN1
SCHEMBL19270706 0.80 PDE4A (0.33) KDM4EALDH1A1
SCHEMBL19272933 0.79 PDE4B (0.34) REN
SCHEMBL21175971 0.72 SLC6A4 (0.36) KDM4ESLC6A4USP2RENALDH1A1
SCHEMBL18424750 0.71 PDE4B (0.38) SLC6A4REN
SCHEMBL29613166 0.71 PDE4B (0.38) SLC6A4REN
SCHEMBL19252786 0.71 LMNA (0.33) KDM4ESLC6A4USP2ALDH1A1KMT2A
SCHEMBL29613229 0.71 LMNA (0.33) KDM4ESLC6A4USP2ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11058678-B2 Substituted heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-07-13 US disclosed
WO-2019143902-A2 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
US-20190224188-A1 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2019-07-25 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-20190224188-A1 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HDGF, HAVCR2 KDM4E 1806/4885SLC6A4 4414/4885USP2 3480/4885
US-11058678-B2 Substituted heterocycles as antiviral agents HCCS, HDGF, HAVCR2 KDM4E 1806/4885SLC6A4 4414/4885USP2 3480/4885

“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.