SCHEMBL30900433

SCHEMBL30900433

CN1CCN(c2ccc(OC(F)(F)F)c(Nc3ncc(Cl)c(Cl)n3)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 18/20 0.57
▸ FLT3 P36888 5/20 0.57
▸ PLK3 Q9H4B4 4/20 0.57
▸ PLK2 Q9NYY3 4/20 0.57
▸ NEK6 Q9HC98 2/20 0.57
▸ CCNA2 P20248 1/20 0.54
▸ CDK2 P24941 1/20 0.54
▸ CCNA1 P78396 1/20 0.54
▸ ALK Q9UM73 1/20 0.53
▸ CSNK2A2 P19784 1/20 0.53
▸ CSNK2B P67870 1/20 0.53
▸ CSNK2A1 P68400 1/20 0.53
▸ MELK Q14680 1/20 0.53
▸ CSNK2A3 Q8NEV1 1/20 0.53
▸ BRD4 O60885 2/20 0.51

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
SCHEMBL29226213 1.00 PLK1 (0.57) PLK1FLT3PLK3PLK2NEK6
SCHEMBL29226256 0.91 PLK1 (0.59) PLK1FLT3PLK3PLK2NEK6
SCHEMBL29226302 0.89 EGFR (0.58) PLK1FLT3PLK3PLK2NEK6
SCHEMBL29226315 0.85 PLK1 (0.63) PLK1FLT3PLK3PLK2NEK6
SCHEMBL30825072 0.85 PLK1 (0.63) PLK1FLT3PLK3PLK2NEK6
SCHEMBL38652813 0.84 PLK1 (0.52) PLK1FLT3PLK3PLK2NEK6
SCHEMBL38652678 0.81 PLK1 (0.55) PLK1FLT3PLK3PLK2NEK6
SCHEMBL30900315 0.81 PLK1 (0.66) PLK1FLT3PLK3PLK2NEK6
SCHEMBL29226318 0.81 PLK1 (0.66) PLK1FLT3PLK3PLK2NEK6
SCHEMBL30900402 0.80 PLK1 (0.62) PLK1FLT3PLK3PLK2NEK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117658987-A Compounds as PLK1 inhibitors, and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-03-08 — — CN disclosed
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