SCHEMBL26928451

SCHEMBL26928451

CN(C)CCN(C)C(=O)c1ccc(N=C(c2ccccc2)c2c(O)[nH]c3cc(C(=O)O)ccc23)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.70
PDGFRB P09619 15/20 0.70
FLT1 P17948 13/20 0.70
FGFR1 P11362 12/20 0.70
FGFR3 P22607 12/20 0.70
PDGFRA P16234 12/20 0.70
MELK Q14680 1/20 0.60
MAP2K5 Q13163 1/20 0.57
MAPK7 Q13164 1/20 0.57
FLT4 P35916 1/20 0.55

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
SCHEMBL26928496 0.91 KDR (0.84) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL26928536 0.82 KDR (0.61) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL29418239 0.75 KDR (0.85) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL30341852 0.75 MELK (1.00) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL29374889 0.75 MAP2K5 (0.83) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL30197767 0.75 MAP2K5 (0.83) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL26928576 0.74 KDR (0.69) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL31046829 0.73 MAP2K5 (1.00) KDRPDGFRBFLT1FGFR1FGFR3
SCHEMBL6598473 0.69 KMT2A (0.51)
SCHEMBL30197784 0.68 PDGFRB (1.00) KDRPDGFRBFLT1FGFR1FGFR3

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-2023240271-A1 USE OF VEGFR2 AND FGFR1 INHIBITORS IN THERAPY FOUNTAIN THERAPEUTICS INC. (US) 2023-12-14 WO disclosed