SCHEMBL21893355

SCHEMBL21893355

CCCCCCC(C)(CCCC)c1cncs1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.33
CNR1 P21554 2/20 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
SCHEMBL22023773 0.98 CNR2 (0.33) CNR2CNR1
SCHEMBL22024188 0.98 CNR2 (0.30) CNR2CNR1
SCHEMBL20047590 0.98 CNR2 (0.33) CNR2CNR1
SCHEMBL18799823 0.98 CNR2 (0.33) CNR2CNR1
SCHEMBL21191748 0.98 CNR2 (0.33) CNR2CNR1
SCHEMBL24676640 0.95 CNR2 (0.32) CNR2CNR1
SCHEMBL21398067 0.95 HDAC8 (0.30)
SCHEMBL22964748 0.92 CNR2 (0.32) CNR2CNR1
SCHEMBL21191752 0.85 CNR2 (0.38) CNR2CNR1
SCHEMBL25627108 0.84 HDAC8 (0.32)

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-11802125-B2 Functionalized heterocyclic compounds as antiviral agents ENANTA PHARMACEUTICALS, INC. 2023-10-31 US disclosed
US-11084817-B2 Farnesoid X receptor agonists and uses thereof METACRINE, INC. (US) 2021-08-10 US disclosed
US-20200102308-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF ELI LILLY AND COMPANY 2020-04-02 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 (3 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-11802125-B2 Functionalized heterocyclic compounds as antiviral agents HAVCR2, HDGF, HCCS CNR2 3458/4885CNR1 2568/4885
US-20200102308-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 CNR2 209/4885CNR1 113/4885
US-11084817-B2 Farnesoid X receptor agonists and uses thereof NR1H4, NR1H2, NR1H3 CNR2 209/4885CNR1 113/4885

“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.