SCHEMBL21690604

SCHEMBL21690604

CC(C)N1CCN(C(C)(C)CCC(C)(C)N2CCN(C(C)(C)C)C2=O)C1=S

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL21533953 0.84 — —
SCHEMBL21325293 0.79 — —
SCHEMBL22751116 0.77 — —
SCHEMBL12528611 0.75 PIK3CD (0.33) —
SCHEMBL611663 0.69 POLB (0.35) —
SCHEMBL25666129 0.68 HRH3 (0.31) —
SCHEMBL19465187 0.68 — —
SCHEMBL18792809 0.67 PIK3CD (0.32) —
SCHEMBL24335867 0.66 PKM (0.30) —
SCHEMBL19443027 0.65 PER2 (0.36) —

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-11247984-B2 Uracil containing compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2022-02-15 — — US disclosed
US-20200039966-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-02-06 — — US disclosed
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