SCHEMBL23948775

SCHEMBL23948775

N#Cc1cncc(COc2cc(OOc3cc(OCc4cncc(C#N)c4)c(C=O)cc3Cl)c(Cl)cc2C=O)c1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 18/20 0.48
PDCD1 Q15116 13/20 0.48
MRGPRX4 Q96LA9 2/20 0.39

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
SCHEMBL25701662 0.91 CD274 (0.46) CD274PDCD1MRGPRX4
SCHEMBL22748209 0.91 CD274 (0.48) CD274PDCD1
SCHEMBL23949387 0.90 CD274 (0.50) CD274PDCD1MRGPRX4
SCHEMBL24613148 0.88 CD274 (0.49) CD274PDCD1MRGPRX4
SCHEMBL21199744 0.87 CD274 (0.43) CD274PDCD1MRGPRX4
SCHEMBL18757330 0.87 CD274 (0.43) CD274PDCD1MRGPRX4
SCHEMBL30406865 0.87 CD274 (0.43) CD274PDCD1MRGPRX4
SCHEMBL20539877 0.86 CD274 (0.61) CD274PDCD1MRGPRX4
SCHEMBL29724447 0.86 CD274 (0.61) CD274PDCD1MRGPRX4
SCHEMBL25235488 0.85 CD274 (0.46) 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 2/4885MRGPRX4 2038/4885

“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.