SCHEMBL31662026

SCHEMBL31662026

Cn1ncc2cc(C(N)=O)c(Oc3ccc(OCCC(=O)N4CCNC(=O)C4)cc3F)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN7A Q01118 3/20 0.37
KCNH2 Q12809 3/20 0.37
PARP1 P09874 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
THRB P10828 1/20 0.35
SCN9A Q15858 4/20 0.35
TSHR P16473 1/20 0.35
PLK4 O00444 1/20 0.33
NTRK1 P04629 1/20 0.33
RET P07949 1/20 0.33
MET P08581 1/20 0.33
AXL P30530 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
MST1R Q04912 1/20 0.33
DDR1 Q08345 1/20 0.33
MERTK Q12866 1/20 0.33
CAMK4 Q16566 1/20 0.33
DDR2 Q16832 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
SCHEMBL31662130 0.90 PARP1 (0.40) KCNH2PARP1SCN9APLK4NTRK1
SCHEMBL31662208 0.87 HPGD (0.42) KCNH2SCN9ANTRK1PDE2APDE3B
SCHEMBL31661937 0.86 PDE3B (0.39) SCN7AKCNH2L3MBTL1SCN9ANTRK1
SCHEMBL31662140 0.85 GAA (0.46) NTRK1RETPDE2APDE3BPDE3A
SCHEMBL31662211 0.84 NTRK1 (0.40) KCNH2NTRK1
SCHEMBL31662183 0.84 SCN9A (0.39) SCN9APLK4NTRK1RETMET
SCHEMBL31662441 0.83 SCN9A (0.37) L3MBTL1SCN9APLK4NTRK1RET
SCHEMBL31662714 0.82 PDE3B (0.42) PARP1SCN9APDE3BPDE3A
SCHEMBL31662000 0.79 DRD4 (0.34) SCN9APLK4NTRK1RETMET
SCHEMBL31662023 0.78 PDK2 (0.42) TSHR

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