SCHEMBL29923985

SCHEMBL29923985

Oc1ccc(F)cc1OC1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
PDE4B Q07343 4/20 0.38
SCD O00767 2/20 0.37
CSNK2A1 P68400 2/20 0.37
PDE4A P27815 4/20 0.37
PDE4C Q08493 2/20 0.37
PDE4D Q08499 2/20 0.37
EPHX2 P34913 1/20 0.37
CA3 P07451 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
MCHR1 Q99705 2/20 0.36
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL29435955 0.93 SCD (0.39) EIF4EMKNK1MKNK2SCDEPHX2
SCHEMBL22203193 0.93 SCD (0.39) EIF4EMKNK1MKNK2SCDEPHX2
SCHEMBL874170 0.79 NPY1R (0.47) PDE4BCSNK2A1PDE4APDE4CPDE4D
SCHEMBL23099857 0.79 EIF4E (0.40) EIF4EMKNK1MKNK2SCDCSNK2A1
SCHEMBL15534488 0.79 MCHR1 (0.42) EIF4EMKNK1MKNK2PDE4BSCD
SCHEMBL24925307 0.79 EIF4E (0.43) EIF4EMKNK1MKNK2SCDCSNK2A1
SCHEMBL20064064 0.78 FFAR4 (0.45) EIF4EMKNK1MKNK2SCDEPHX2
SCHEMBL2908060 0.77 PDE4A (0.51) PDE4BPDE4APDE4CPDE4D
SCHEMBL873580 0.77 CA1 (0.45) PDE4BPDE4APDE4CPDE4DMCHR1
SCHEMBL23250796 0.77 SCD (0.37) EIF4EMKNK1MKNK2SCDEPHX2

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-112390745-B Pyridine nicotinamide derivatives, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-10-21 CN disclosed