SCHEMBL28647019

SCHEMBL28647019

C=CC(=O)NC1CCC(OC(N)=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 5/20 0.48
SMYD3 Q9H7B4 1/20 0.40
POLB P06746 1/20 0.39
EPHX1 P07099 1/20 0.37
BTK Q06187 4/20 0.35
EPHX2 P34913 1/20 0.33
TGM2 P21980 1/20 0.33
JAK3 P52333 1/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
ATM Q13315 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL308515 0.81
SCHEMBL9624068 0.81 POLB (0.54) TEAD1SMYD3POLBEPHX1EPHX2
SCHEMBL18752837 0.79 TEAD1 (0.45) TEAD1SMYD3POLBEPHX1BTK
SCHEMBL18753607 0.79 TEAD1 (0.45) TEAD1SMYD3POLBEPHX1BTK
SCHEMBL24492194 0.79 TEAD1 (0.50) TEAD1SMYD3POLBEPHX2JAK3
SCHEMBL5263260 0.78 EPHX1 (0.41) SMYD3POLBEPHX1EPHX2NPC1
SCHEMBL5263263 0.78 EPHX1 (0.41) SMYD3POLBEPHX1EPHX2NPC1
SCHEMBL22660898 0.77 POLB (0.47) TEAD1SMYD3POLBBTKEPHX2
SCHEMBL30716262 0.77 POLB (0.42) TEAD1SMYD3POLBBTKHTT
SCHEMBL19409139 0.76 POLB (0.45) TEAD1SMYD3POLBHTT

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
CN-113490666-A Substituted pyrazolo [1,5-A ] pyridine compounds as inhibitors of FGFR tyrosine kinases 奥瑞生物药品公司 2021-10-08 CN disclosed