SCHEMBL4084078

SCHEMBL4084078

CN1CCC(Oc2ccc(C(=O)Nc3n[nH]c4cc(C(=O)O)oc34)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIT P10721 8/20 0.57
FLT3 P36888 7/20 0.57
DYRK1A Q13627 8/20 0.44
GSK3B P49841 7/20 0.44
CLK2 P49760 3/20 0.44
CLK3 P49761 3/20 0.44
WNT1 P04628 2/20 0.44
INSR P06213 1/20 0.44
IGF1R P08069 1/20 0.44
ALK Q9UM73 1/20 0.44

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
SCHEMBL4081942 0.87 KIT (0.54) KITFLT3DYRK1AGSK3BCLK2
SCHEMBL3881539 0.83 AURKA (0.60) KITFLT3INSRIGF1RALK
SCHEMBL4088594 0.82 GPR35 (0.55)
SCHEMBL4088196 0.82 KDR (0.54) KITFLT3INSRIGF1RALK
SCHEMBL3883058 0.81 AURKA (0.59) KITFLT3
SCHEMBL4081022 0.79 FLT3 (0.50) KITFLT3
SCHEMBL2431632 0.79 KIT (0.57) KITFLT3DYRK1AGSK3BCLK2
SCHEMBL4089596 0.79 FLT3 (0.49) KITFLT3ALK
SCHEMBL4082126 0.77 HDAC6 (0.48) GSK3B
SCHEMBL24244969 0.77 KIT (0.66) KITFLT3DYRK1A

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
EP-2058315-A1 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors Nerviano Medical Sciences S.r.l. (IT) 2009-05-13 EP claimed
EP-2058315-A1 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors Nerviano Medical Sciences S.r.l. (IT) 2009-05-13 EP disclosed