SCHEMBL23368136

SCHEMBL23368136

CC(C)(C)NC(=O)n1ccc(Cc2cc(F)c(N)cc2F)n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 5/20 0.32
CSNK1D P48730 4/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.30
SCN4A P35499 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP3A5 P20815 1/20 0.30
ANO1 Q5XXA6 1/20 0.30

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
SCHEMBL23355349 0.75 SCN4A (0.32) CSNK1ECSNK1DSCN4A
SCHEMBL348058 0.72 RAB9A (0.38) CNR1CNR2
SCHEMBL21616328 0.70 SCN4A (0.37) CSNK1ECSNK1DSCN4A
SCHEMBL23368169 0.70 FYN (0.30)
SCHEMBL23368117 0.67 HTR2A (0.30)
SCHEMBL161438 0.66 P2RX4 (0.39) CSNK1ECSNK1DSCN4A
SCHEMBL348418 0.66 NOS1 (0.46)
SCHEMBL21612791 0.64 SCN4A (0.34) CSNK1ECSNK1DSCN4A
SCHEMBL23355324 0.63 SCN4A (0.34) CNR1CNR2SCN4A
SCHEMBL23368130 0.62 P2RX4 (0.36) CSNK1ECSNK1DCNR1SCN4A

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-3822263-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2021-05-19 EP disclosed