SCHEMBL30980809

SCHEMBL30980809

COc1nc(-c2cccc(-c3ccnc(-c4ccc5c(c4)CCCC5NC[C@@H]4CCC(=O)N4)c3Cl)c2Cl)ccc1CN(C[C@@H]1CCC(=O)N1)C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.48
▸ PDCD1LG2 Q9BQ51 18/20 0.48
▸ PDCD1 Q15116 2/20 0.46

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
SCHEMBL29983818 0.97 CD274 (0.54) CD274PDCD1LG2PDCD1
SCHEMBL29984159 0.96 CD274 (0.45) CD274PDCD1LG2PDCD1
SCHEMBL27080181 0.93 CD274 (0.50) CD274PDCD1LG2PDCD1
SCHEMBL27080172 0.93 CD274 (0.50) CD274PDCD1LG2PDCD1
SCHEMBL29983914 0.89 CD274 (0.46) CD274PDCD1LG2PDCD1
SCHEMBL23726258 0.88 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL30432925 0.88 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL29983734 0.87 CD274 (0.44) CD274PDCD1LG2PDCD1
SCHEMBL27079267 0.85 PDCD1LG2 (0.67) CD274PDCD1LG2
SCHEMBL27078369 0.85 PDCD1LG2 (0.67) CD274PDCD1LG2

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-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-25 — — 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 (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-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME HAVCR2, HDGF, HCCS CD274 48/4885PDCD1LG2 163/4885PDCD1 32/4885

“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.

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