SCHEMBL28532459

SCHEMBL28532459

CCN1CCN(c2ccc(Nc3ncc(C#N)c(NC(C)C)n3)c(OC(N)=O)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 2/20 0.49
▸ FGFR2 P21802 1/20 0.49
▸ FGFR4 P22455 1/20 0.49
▸ FGFR3 P22607 1/20 0.49
▸ PLK1 P53350 2/20 0.48
▸ ALK Q9UM73 9/20 0.48
▸ LRRK2 Q5S007 5/20 0.48
▸ JAK3 P52333 2/20 0.48
▸ IGF1R P08069 2/20 0.48
▸ PDGFRA P16234 2/20 0.48
▸ AURKA O14965 1/20 0.48
▸ DAPK3 O43293 1/20 0.48
▸ JAK2 O60674 1/20 0.48
▸ PRKD3 O94806 1/20 0.48
▸ MAP4K4 O95819 1/20 0.48
▸ PAK4 O96013 1/20 0.48
▸ LCK P06239 1/20 0.48
▸ FYN P06241 1/20 0.48
▸ CSF1R P07333 1/20 0.48
▸ RET P07949 1/20 0.48

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
SCHEMBL30379611 1.00 FGFR1 (0.49) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL21596341 0.90 EGFR (0.48) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL28533769 0.88 ALK (0.56) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL30379391 0.87 LRRK2 (0.49) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL28909338 0.87 ALK (0.55) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL21596322 0.85 LRRK2 (0.42) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL21596323 0.85 PDGFRA (0.53) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL21596320 0.85 ALK (0.41) FGFR1FGFR2FGFR4FGFR3PLK1
SCHEMBL28953574 0.85 ALK (0.53) ALKIGF1RCDK2
SCHEMBL28953571 0.85 ALK (0.58) FGFR1FGFR2FGFR4FGFR3PLK1

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
CN-112313207-B Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2023-02-14 — — CN disclosed
CN-112313207-A Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2021-02-02 — — CN disclosed
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