SCHEMBL30935374

SCHEMBL30935374

C=CC(=O)Nc1cc(B2OC(C)(C)C(C)(C)O2)c(F)cc1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 11/20 0.35
FGFR4 P22455 11/20 0.35
TGM2 P21980 2/20 0.35
BTK Q06187 3/20 0.34
ITK Q08881 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PDGFRB P09619 1/20 0.32
KDR P35968 1/20 0.32
CXCR2 P25025 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
SCHEMBL16632449 0.83 CA1 (0.37) BTKCA1CA2CA9PDGFRB
SCHEMBL30227001 0.81 TGM2 (0.47) TGM2BTKITKCXCR2
SCHEMBL30935033 0.81 TGM2 (0.47) TGM2BTKITK
SCHEMBL30226989 0.81 CA1 (0.47) TGM2CA1CA2CA9PDGFRB
SCHEMBL16123326 0.81 PDGFRB (0.42) FGFR1FGFR4TGM2BTKITK
SCHEMBL15289558 0.79 PDGFRB (0.33) CA1CA2CA9PDGFRBKDR
SCHEMBL30935246 0.78 LIPE (0.38) FGFR1FGFR4TGM2BTKCXCR2
SCHEMBL16100601 0.77 LIPE (0.45) TGM2BTK
SCHEMBL16667637 0.74 NPC1 (0.40) CA1CA2CA9PDGFRBKDR
SCHEMBL15271999 0.74 CA1 (0.36) BTKCA1CA2CA9PDGFRB

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
WO-2024125464-A1 TETRAHYDROISOQUINOLIN-ONE DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-20 WO disclosed