SCHEMBL13664796

SCHEMBL13664796

CC(C)(C)OC(=O)NCC(F)(F)CNc1ccc(Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 1/20 0.40
HSP90AA1 P07900 1/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP3A4 P08684 1/20 0.40
GRIN1 Q05586 3/20 0.39
GRIN2B Q13224 3/20 0.39
TSHR P16473 1/20 0.39
EGFR P00533 1/20 0.39
AURKB Q96GD4 1/20 0.39
EPHX1 P07099 1/20 0.38

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
SCHEMBL13664868 0.82 STK17B (0.55) MEN1KMT2ALMNAHTTMAPT
SCHEMBL13664819 0.82 STK17B (0.52) LMNAHTTGRIN1GRIN2BIDO1
SCHEMBL13664899 0.78 PCSK9 (0.48) MEN1KMT2ALMNAHTTMAPT
SCHEMBL13664688 0.76 KMT2A (0.42) MEN1KMT2ALMNAHTTMAPT
SCHEMBL19932072 0.75 EGFR (0.57) MEN1KMT2ALMNAHTTMAPT
SCHEMBL13664727 0.75 CETP (0.35) MEN1KMT2ALMNAHTTMAPT
SCHEMBL16303890 0.75 EPHX1 (0.58) MEN1KMT2ALMNAHTTMAPT
SCHEMBL735192 0.75 L3MBTL1 (0.47) MEN1KMT2ALMNAHTTMAPT
SCHEMBL29894737 0.74 EGFR (0.51) MEN1KMT2ALMNAHTTMAPT
SCHEMBL13665284 0.74 AAK1 (0.43) MEN1KMT2ALMNAHTTMAPT

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
WO-2009119528-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed