SCHEMBL16655519

SCHEMBL16655519

Clc1cc(Cl)cc(CNc2ccnc(Cl)n2)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 11/20 0.54
POLB P06746 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALDH1A1 P00352 2/20 0.44
GBA1 P04062 1/20 0.44
MAPK1 P28482 1/20 0.44
DYRK1A Q13627 6/20 0.44
CLK1 P49759 1/20 0.43
CLK2 P49760 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
KDM4E B2RXH2 2/20 0.41
CYP2C9 P11712 1/20 0.41
ACHE P22303 2/20 0.40
BACE1 P56817 1/20 0.40

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
SCHEMBL4554748 0.86 MAP4K4 (0.54) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL8241275 0.85 KDM4E (0.58) CLK4POLBCYP1A2CYP3A4CYP2D6
SCHEMBL1666752 0.81 CYP1A2 (0.64) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL28531568 0.80 CLK4 (0.58) CLK4POLBCYP1A2CYP3A4CYP2D6
SCHEMBL4648432 0.79 ALDH1A1 (0.54) CLK4POLBCYP1A2CYP3A4CYP2D6
SCHEMBL13504222 0.75 CLK4 (0.68) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL4644302 0.75 RAB9A (0.58) CLK4POLBCYP1A2CYP3A4CYP2D6
SCHEMBL15534955 0.75 CYP1A2 (0.49) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL14554854 0.74 MEN1 (0.48) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL14486807 0.74 SLC2A1 (0.46) CLK4POLBDYRK1A

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-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed