SCHEMBL30797774

SCHEMBL30797774

Cc1nncn1-c1cc(NC(=O)COCCCCNC(=O)OC(C)(C)C)c2cnn(C3CCCCO3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 3/20 0.40
▸ BRD4 O60885 9/20 0.34
▸ TSHR P16473 3/20 0.34
▸ TP53 P04637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ FPR3 P25089 2/20 0.32
▸ FPR2 P25090 2/20 0.32
▸ TRIM24 O15164 1/20 0.32
▸ KRAS P01116 1/20 0.31
▸ GBA1 P04062 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
SCHEMBL30797659 0.90 ATR (0.41) ATRBRD4
SCHEMBL27377492 0.90 ATR (0.41) ATRBRD4
SCHEMBL30797676 0.89 ATR (0.42) ATRBRD4TSHRTP53ALDH1A1
SCHEMBL30797740 0.85 ATR (0.43) ATRBRD4TSHRTP53ALDH1A1
SCHEMBL30869153 0.81 ATR (0.41) ATRBRD4TSHRTP53ALDH1A1
SCHEMBL30869008 0.80 ATR (0.39) ATRTSHRALDH1A1HPGDNPSR1
SCHEMBL30797851 0.79 ATR (0.43) ATRBRD4FPR3FPR2TRIM24
SCHEMBL27376514 0.78 ATR (0.42) ATRBRD4FPR3FPR2TRIM24
SCHEMBL30869134 0.78 ATR (0.37) ATRKRAS
SCHEMBL30869059 0.76 ATR (0.40) ATRBRD4KRAS

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-4584266-A1 NOVEL COMPOUNDS, COMPOSITIONS AND THERAPEUTIC USES THEREOF Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
EP-4584249-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
WO-2024052701-A1 NOVEL COMPOUNDS, COMPOSITIONS AND THERAPEUTIC USES THEREOF CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — WO disclosed
WO-2024052702-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — WO disclosed
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