SCHEMBL31662065

SCHEMBL31662065

Cn1ncc2cc(C(N)=O)c(Oc3ccc(OCCCN4CCOCC4=O)cc3F)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 1/20 0.39
PRKAG1 P54619 1/20 0.39
PRKAA2 P54646 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAG3 Q9UGI9 1/20 0.39
PRKAG2 Q9UGJ0 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
PDK2 Q15119 1/20 0.39
AOC2 O75106 1/20 0.36
RET P07949 3/20 0.35
DRD4 P21917 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
AR P10275 1/20 0.34
MIF P14174 1/20 0.34
MET P08581 4/20 0.33
AXL P30530 2/20 0.33
MAPK14 Q16539 2/20 0.33
GRM2 Q14416 1/20 0.33
PLK4 O00444 1/20 0.33
NTRK1 P04629 1/20 0.33

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
SCHEMBL31662469 0.93 PRKAB2 (0.45) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL31662477 0.92 PRKAB2 (0.39) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL31662061 0.90 PRKAB2 (0.44) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL31661868 0.89 PDK2 (0.38) PDK2RETDRD4SIGMAR1AR
SCHEMBL31662023 0.88 PDK2 (0.42) PDK2EGFR
SCHEMBL31662183 0.87 SCN9A (0.39) PDK2RETDRD4SIGMAR1MET
SCHEMBL31662181 0.85 PRKAB2 (0.37) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL31662140 0.84 GAA (0.46) RETDRD4SIGMAR1ARNTRK1
SCHEMBL31662441 0.80 SCN9A (0.37) RETARMETAXLMAPK14
SCHEMBL31662208 0.80 HPGD (0.42) DRD4SIGMAR1NTRK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO claimed
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed