SCHEMBL17895887

SCHEMBL17895887

Cn1ncc2c1CCOc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ PLK3 Q9H4B4 1/20 0.36

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
SCHEMBL17895839 0.80 PLK1 (0.47) PLK1CSNK2A1PLK3
SCHEMBL17895885 0.77 PLK1 (0.36) PLK1CSNK2A1PLK3
SCHEMBL17895994 0.77 PLK1 (0.36) PLK1CSNK2A1PLK3
SCHEMBL17895983 0.77 PLK1 (0.36) PLK1CSNK2A1PLK3
SCHEMBL17495175 0.72 — —
SCHEMBL17498127 0.72 KCNA3 (0.33) —
SCHEMBL17498147 0.72 — —
Hydrochloric Acid SCHEMBL17495121 0.72 — —
Hydrochloric Acid SCHEMBL17498115 0.72 KCNA3 (0.32) —
SCHEMBL17495027 0.71 DAO (0.31) —

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
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO claimed
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO disclosed
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO disclosed
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