SCHEMBL23949302

SCHEMBL23949302

COc1nc(OCc2cccc(-c3cccc(COc4nc(OC)c(CN[C@H](C(=O)O)C(C)O)cc4Cl)c3C)c2C)c(Cl)cc1CN[C@H](C(=O)O)C(C)O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 20/20 0.56
PDCD1 Q15116 11/20 0.52
PDCD1LG2 Q9BQ51 1/20 0.44

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
SCHEMBL20539957 1.00 CD274 (0.56) CD274PDCD1PDCD1LG2
SCHEMBL20539517 0.91 CD274 (0.55) CD274PDCD1
SCHEMBL23949234 0.91 CD274 (0.55) CD274PDCD1
SCHEMBL23948964 0.91 CD274 (0.55) CD274PDCD1
SCHEMBL24613096 0.88 CD274 (0.53) CD274PDCD1
SCHEMBL23949486 0.87 CD274 (0.45) CD274PDCD1PDCD1LG2
SCHEMBL23948922 0.87 CD274 (0.49) CD274PDCD1
SCHEMBL23948906 0.87 CD274 (0.55) CD274PDCD1PDCD1LG2
SCHEMBL23949243 0.87 CD274 (0.58) CD274PDCD1
SCHEMBL20539989 0.87 CD274 (0.49) CD274PDCD1

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-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 CD274 1/4885PDCD1 2/4885PDCD1LG2 3/4885

“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.