SCHEMBL23994106

SCHEMBL23994106

CC(C)(C)Oc1ncc(-c2cc(Br)c3nccn3n2)c(OC(C)(C)C)n1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SYK P43405 1/20 0.30

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
SCHEMBL23993446 0.86 NPSR1 (0.42) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224462 0.84 NPSR1 (0.42) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224213 0.82 SYK (0.38) SYK
SCHEMBL23994425 0.82 SYK (0.38) SYK
SCHEMBL30224198 0.82 NPSR1 (0.39) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224274 0.82 NPSR1 (0.41) GAANPSR1ATMMEN1KMT2A
SCHEMBL25005896 0.82 NPSR1 (0.41) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224893 0.82 NPSR1 (0.41) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224896 0.82 NPSR1 (0.39) GAANPSR1ATMMEN1KMT2A
SCHEMBL30224874 0.82 NPSR1 (0.41) GAANPSR1ATMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
US-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 — — US disclosed
CN-115698009-A CD73 inhibiting 2,4-dioxopyrimidine compounds 吉利德科学公司 2023-02-03 — — CN 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 GAA 678/4885NPSR1 1783/4885ATM 1522/4885

“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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