SCHEMBL14748477

SCHEMBL14748477

CC(=O)N1CCN(c2c3c(c(C4CN4)c4nc5ccccc5n24)CCN(CCOc2ccccc2)C3)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.39
KDM4E B2RXH2 2/20 0.38
DRD3 P35462 5/20 0.38
KCNA5 P22460 3/20 0.38
KDM1A O60341 2/20 0.38
PKM P14618 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
DRD2 P14416 3/20 0.36
CYP2D6 P10635 1/20 0.36
KCNH2 Q12809 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTR5A P47898 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
SCHEMBL14728434 0.85 KDM4E (0.54) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728421 0.75 KDM4E (0.56) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728436 0.73 KDM4E (0.55) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728419 0.73 KDM4E (0.56) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14748490 0.71 MAPK1 (0.48) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728410 0.69 KDM4E (0.58) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728418 0.69 KDM4E (0.57) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728391 0.67 KDM4E (0.51) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728402 0.66 KDM4E (0.54) KDM4EPKMTSHRMAPK1CASP1
SCHEMBL14728482 0.66 KDM4E (0.51) KDM4EPKMTSHRMAPK1CASP1

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
EP-2565194-A1 IMIDAZO[1,2-a]PYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2013-03-06 EP disclosed