SCHEMBL22023802

SCHEMBL22023802

CCCCCCC(C)(C)c1c[nH]cn1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.36
CNR1 P21554 15/20 0.34

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
SCHEMBL22023933 0.93 CNR1 (0.30) CNR2CNR1
SCHEMBL22023930 0.86 KDR (0.32) CNR2
SCHEMBL19788362 0.86 KDR (0.32) CNR2
SCHEMBL21719823 0.86 KDR (0.32) CNR2
SCHEMBL23845817 0.85
SCHEMBL23709527 0.85 KDR (0.31)
SCHEMBL22024734 0.83 KMT2A (0.30)
SCHEMBL21982584 0.73 CNR2 (0.33) CNR2CNR1
SCHEMBL25979519 0.72 CNR2 (0.36) CNR2CNR1
SCHEMBL23085646 0.72 CNR2 (0.32) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11198693-B2 Functionalized heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-12-14 US 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 (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-11198693-B2 Functionalized heterocycles as antiviral agents HCCS, HAVCR2, HDGF CNR2 2902/4885CNR1 2040/4885
US-20200165249-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HAVCR2, HDGF CNR2 2902/4885CNR1 2040/4885

“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.