SCHEMBL22149126

SCHEMBL22149126

C=CC(=O)N1CC(F)(C(=O)N2CCN(c3cc(C)c(-c4cnc5ccc(Nc6cc(OC)cc(OC)c6)cc5n4)cn3)CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 1/20 0.43
KDR P35968 1/20 0.43
EGFR P00533 9/20 0.36
ITK Q08881 4/20 0.35
MAPT P10636 4/20 0.34
BTK Q06187 4/20 0.34
TP53 P04637 2/20 0.34
RAD52 P43351 1/20 0.34
PDGFRB P09619 1/20 0.34
POLB P06746 1/20 0.33
SYK P43405 1/20 0.32
CCKAR P32238 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL31655629 1.00 FGFR3 (0.43) FGFR3KDREGFRITKMAPT
SCHEMBL31655622 0.90 FGFR3 (0.39) FGFR3KDREGFRMAPTBTK
SCHEMBL22149197 0.90 FGFR3 (0.39) FGFR3KDREGFRMAPTBTK
SCHEMBL22149693 0.89 FGFR3 (0.48) FGFR3KDREGFRITKBTK
SCHEMBL31655631 0.89 FGFR3 (0.48) FGFR3KDREGFRITKBTK
SCHEMBL22149196 0.81 FGFR3 (0.39) FGFR3KDREGFRBTK
SCHEMBL31655637 0.81 FGFR3 (0.39) FGFR3KDREGFRBTK
SCHEMBL22149690 0.80 FGFR3 (0.44) FGFR3KDREGFRBTKKDM4E
SCHEMBL31655634 0.80 FGFR3 (0.44) FGFR3KDREGFRBTKKDM4E
SCHEMBL22149691 0.80 FGFR3 (0.53) FGFR3KDREGFRITK

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-2020131674-A1 7-((3,5-DIMETHOXYPHENYL)AMINO)QUINOXALINE DERIVATIVES AS FGFR INHIBITORS FOR TREATING CANCER ARRAY BIOPHARMA INC. (US) 2020-06-25 WO disclosed