SCHEMBL8814977

SCHEMBL8814977

Cc1ccc(-c2nc3c(Cc4ccccc4C(F)(F)F)cc(OCCN(C(C)C)C(C)C)cc3[nH]2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 5/20 0.46
▸ PRMT5 O14744 2/20 0.35
▸ LTA4H P09960 1/20 0.33
▸ SCD O00767 1/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ DYRK3 O43781 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ RPS6KB1 P23443 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ PKN2 Q16513 1/20 0.33
▸ PIM3 Q86V86 1/20 0.33
▸ BRSK1 Q8TDC3 1/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ HIPK2 Q9H2X6 1/20 0.33
▸ CLK4 Q9HAZ1 1/20 0.33
▸ MKNK2 Q9HBH9 1/20 0.33
▸ STK17A Q9UEE5 1/20 0.33
▸ MAP4K5 Q9Y4K4 1/20 0.33
▸ MGAM O43451 1/20 0.32

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
SCHEMBL8816922 0.91 ACHE (0.43) ACHEPRMT5DYRK3MAP4K4PIM1
SCHEMBL8818801 0.90 ACHE (0.44) ACHEPRMT5LTA4HSCDDYRK3
SCHEMBL8816636 0.88 ACHE (0.39) ACHEPRMT5DYRK3MAP4K4PIM1
SCHEMBL8817108 0.87 ACHE (0.48) ACHEPRMT5LTA4HMCHR1DYRK3
SCHEMBL8817000 0.87 PRMT5 (0.34) PRMT5SCDMGAMGAASI
SCHEMBL8817603 0.85 ACHE (0.42) ACHEPRMT5LTA4HMCHR1
SCHEMBL8814868 0.83 PRMT5 (0.32) PRMT5SCDMGAMGAASI
SCHEMBL8079568 0.82 ACHE (0.46) ACHEPRMT5LTA4HDHODHADORA2A
SCHEMBL8818545 0.81 DYRK3 (0.45) ACHEDYRK3MAP4K4PIM1RPS6KB1
SCHEMBL8814846 0.79 MGAM (0.39) PRMT5LTA4HMGAMGAASI

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-1997031635-A1 METHODS OF TREATING OR PREVENTING SLEEP APNEA ELI LILLY AND COMPANY (US) 1997-09-04 — — WO disclosed
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