SCHEMBL22294666

SCHEMBL22294666

CCCCCC1(CCCCC)c2ccccc2-c2ccc(N)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.44
CHEK1 O14757 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
RET P07949 1/20 0.42
MET P08581 1/20 0.42
PDGFRA P16234 1/20 0.42
FLT1 P17948 1/20 0.42
LTK P29376 1/20 0.42
PRKX P51817 1/20 0.42
NEK2 P51955 1/20 0.42
JAK3 P52333 1/20 0.42
BTK Q06187 1/20 0.42
MAP4K2 Q12851 1/20 0.42
DYRK1A Q13627 1/20 0.42
TAOK1 Q7L7X3 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
APEX1 P27695 1/20 0.38
SMN1; SMN2 Q16637 4/20 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
SCHEMBL27789288 0.98 PDK2 (0.43) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL30435035 0.98 PDK2 (0.43) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL2804322 0.98 PDK2 (0.43) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL30656642 0.95 PDK2 (0.45) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL12095513 0.95 PDK2 (0.45) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL30543304 0.91 CHEK1 (0.40) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL2776896 0.91 CHEK1 (0.40) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL30569604 0.91 CHEK1 (0.40) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL30569606 0.91 CHEK1 (0.40) PDK2CHEK1PRKD3MAP4K4RET
SCHEMBL2893208 0.91 CHEK1 (0.40) PDK2CHEK1PRKD3MAP4K4RET

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-3115395-B1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE MITSUBISHI CHEM CORP (JP) 2020-08-05 EP disclosed