SCHEMBL22149124

SCHEMBL22149124

C=CC(=O)N1CC(C(=O)N2CCC(n3ncc(-c4cnc5ccc(Nc6cc(OC)cc(OC)c6)cc5n4)c3C)CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 3/20 0.46
KDR P35968 2/20 0.46
EGFR P00533 7/20 0.40
ITK Q08881 4/20 0.40
FGFR2 P21802 4/20 0.39
FGFR1 P11362 3/20 0.39
FGFR4 P22455 3/20 0.39
BTK Q06187 9/20 0.39

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
SCHEMBL31655620 1.00 FGFR3 (0.46) FGFR3KDREGFRITKFGFR2
SCHEMBL22122045 0.86 FGFR3 (0.55) FGFR3KDRFGFR2FGFR1FGFR4
SCHEMBL31655628 0.84 FGFR3 (0.55) FGFR3KDREGFRITKFGFR2
SCHEMBL22149349 0.82 FGFR3 (0.55) FGFR3KDREGFRITKFGFR2
SCHEMBL31655636 0.82 FGFR3 (0.55) FGFR3KDREGFRITKFGFR2
SCHEMBL22149692 0.81 FGFR3 (0.50) FGFR3KDREGFRITKFGFR2
SCHEMBL31655616 0.81 FGFR3 (0.50) FGFR3KDREGFRITKFGFR2
SCHEMBL22149350 0.81 FGFR3 (0.56) FGFR3KDRFGFR2FGFR1FGFR4
SCHEMBL31655633 0.81 FGFR3 (0.56) FGFR3KDRFGFR2FGFR1FGFR4
SCHEMBL22149125 0.80 FGFR3 (0.58) FGFR3KDRFGFR2FGFR1FGFR4

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