SCHEMBL31661880

SCHEMBL31661880

Cn1ncc2cc(C(N)=O)c(Oc3ccc(OCCCn4ccccc4=O)cc3F)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.36
PLK4 O00444 1/20 0.36
NTRK1 P04629 1/20 0.36
RET P07949 1/20 0.36
MET P08581 1/20 0.36
KDR P35968 1/20 0.36
FLT3 P36888 1/20 0.36
MST1R Q04912 1/20 0.36
DDR1 Q08345 1/20 0.36
MERTK Q12866 1/20 0.36
CAMK4 Q16566 1/20 0.36
DDR2 Q16832 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36
NPC1 O15118 1/20 0.35
MITF O75030 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL31662441 0.83 SCN9A (0.37) AXLPLK4NTRK1RETMET
SCHEMBL31662023 0.81 PDK2 (0.42) SMN1; SMN2
SCHEMBL31662183 0.81 SCN9A (0.39) AXLPLK4NTRK1RETMET
SCHEMBL31661868 0.81 PDK2 (0.38) AXLPLK4NTRK1RETMET
SCHEMBL31662065 0.79 PRKAB2 (0.39) AXLPLK4NTRK1RETMET
SCHEMBL31661852 0.79 PDK2 (0.38) NTRK1PARP10HTR3AROCK2SCN9A
SCHEMBL31662208 0.79 HPGD (0.42) NTRK1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL31661937 0.78 PDE3B (0.39) NTRK1RAB9ASMN1; SMN2L3MBTL1ROCK2
SCHEMBL31662520 0.76 AR (0.40) AXLPLK4NTRK1RETMET
SCHEMBL31662264 0.76 SCN9A (0.40) AXLPLK4NTRK1RETMET

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