SCHEMBL30869076

SCHEMBL30869076

C[C@@H](CCCOCCNc1cc(Br)cc2c1cnn2C1CCCCO1)NC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 3/20 0.36
▸ IDO1 P14902 2/20 0.36
▸ TDO2 P48775 2/20 0.36
▸ AAK1 Q2M2I8 6/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ HRH2 P25021 2/20 0.31
▸ HRH1 P35367 2/20 0.31
▸ KRAS P01116 1/20 0.31
▸ CACNA1B Q00975 1/20 0.30
▸ ITGAV P06756 1/20 0.30
▸ ITGB6 P18564 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
SCHEMBL30869053 0.89 ATR (0.34) ATRRXRARXRBRXRG
SCHEMBL30797730 0.89 ATR (0.44) ATRIDO1TDO2RXRARXRB
SCHEMBL30869099 0.88 ATR (0.36) ATRRXRARXRBRXRGKRAS
SCHEMBL30869047 0.87 ATR (0.33) ATRAAK1RXRARXRBRXRG
SCHEMBL30869072 0.86 ATR (0.34) ATRRXRARXRBRXRG
SCHEMBL27378131 0.80 RXRA (0.39) ATRIDO1TDO2AAK1RXRA
SCHEMBL30797598 0.80 RXRA (0.39) ATRIDO1TDO2AAK1RXRA
SCHEMBL30797740 0.79 ATR (0.43) ATRIDO1TDO2RXRARXRB
SCHEMBL30869074 0.79 ATR (0.43) ATRTDO2RXRARXRBRXRG
SCHEMBL30869065 0.78 ATR (0.42) ATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260085062-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CAMBRIDGE ENTPR LTD (GB) 2026-03-26 — — US disclosed
EP-4584249-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
WO-2024052702-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — 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-20260085062-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CSNK1A1, CSNK1G1, CSNK2A3 ATR 984/4885IDO1 1378/4885TDO2 1813/4885

“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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