SCHEMBL23993758

SCHEMBL23993758

N#Cc1cccc(C2CC2c2cc(-c3c[nH]c(=O)[nH]c3=O)nn3ccnc23)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 6/20 0.39
▸ SYK P43405 1/20 0.36
▸ NR3C1 P04150 1/20 0.34
▸ KDM1A O60341 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ LRRK2 Q5S007 4/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ ABCC9 O60706 1/20 0.31
▸ ABCC8 Q09428 1/20 0.31
▸ KCNJ11 Q14654 1/20 0.31
▸ KCNJ8 Q15842 1/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GRM5 P41594 1/20 0.31

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
SCHEMBL25005749 1.00 NT5E (0.39) NT5ESYKNR3C1KDM1AJAK2
SCHEMBL25005409 0.90 NT5E (0.41) NT5ESYKJAK2TYK2ALDH1A1
SCHEMBL25005476 0.90 NT5E (0.41) NT5ESYKJAK2TYK2ALDH1A1
SCHEMBL23995102 0.90 NT5E (0.41) NT5ESYKJAK2TYK2ALDH1A1
SCHEMBL23993775 0.90 NT5E (0.41) NT5ESYKJAK2TYK2ALDH1A1
SCHEMBL23993668 0.89 NT5E (0.42) NT5EALDH1A1
SCHEMBL23993703 0.89 NT5E (0.42) NT5EALDH1A1
SCHEMBL25004844 0.89 NT5E (0.42) NT5EALDH1A1
SCHEMBL23995165 0.88 NT5E (0.39) NT5ENR3C1ALDH1A1
SCHEMBL30224866 0.88 NT5E (0.39) NT5ENR3C1ALDH1A1

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-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 — — US disclosed
WO-2021222522-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-11-04 — — WO 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-20230039553-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E NT5E 3/4885SYK 2578/4885NR3C1 2576/4885

“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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