SCHEMBL1675337

SCHEMBL1675337

CCOC(=O)c1ccc(-c2ccc3ncnc(NCc4cccs4)c3c2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 18/20 1.00
DYRK1A Q13627 8/20 1.00
CLK1 P49759 5/20 1.00
CLK2 P49760 3/20 1.00
DYRK1B Q9Y463 3/20 1.00
LMNA P02545 7/20 0.59
CYP1A2 P05177 6/20 0.59
CYP3A4 P08684 6/20 0.59
CYP2D6 P10635 6/20 0.59
CYP2C19 P33261 6/20 0.59
ALDH1A1 P00352 5/20 0.59
MAPK1 P28482 5/20 0.59
HIF1A Q16665 4/20 0.59
TSHR P16473 3/20 0.59
HSD17B10 Q99714 3/20 0.59
CYP2C9 P11712 3/20 0.59
MAPT P10636 2/20 0.59
KDM4E B2RXH2 1/20 0.59
HPGD P15428 1/20 0.59
USP2 O75604 4/20 0.59

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
SCHEMBL1675052 0.87 CLK4 (1.00) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675054 0.85 CLK4 (1.00) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675223 0.84 CLK4 (0.73) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675116 0.82 CLK4 (0.72) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675050 0.80 CLK4 (1.00) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675336 0.79 CLK1 (0.68) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675091 0.79 CLK4 (0.72) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675153 0.79 CLK4 (0.85) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675185 0.79 CLK4 (0.65) CLK4DYRK1ACLK1CLK2DYRK1B
SCHEMBL1675126 0.76 CLK4 (1.00) CLK4DYRK1ACLK1CLK2DYRK1B

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-2011041655-A1 QUINAZOLIN-4-AMINE DERIVATIVES; AND METHODS OF USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-04-07 WO claimed