SCHEMBL31662413

SCHEMBL31662413

COC(=O)c1cc(Oc2ccc(OCCOC3CCOCC3)cc2)c2[nH]ncc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD38 P28907 5/20 0.39
MAPT P10636 3/20 0.37
HPGDS O60760 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
PDE4D Q08499 1/20 0.35
RAB9A P51151 2/20 0.35
NAMPT P43490 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE4B Q07343 1/20 0.34
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33
LRRK2 Q5S007 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
SCHEMBL31662059 0.89 PDE4D (0.35) CD38PDE4DNAMPT
SCHEMBL31662620 0.82 CD38 (0.40) CD38MAPTHPGDSL3MBTL1TDP1
SCHEMBL17888595 0.78 MAPT (0.44) MAPTL3MBTL1TDP1PDE4DRAB9A
SCHEMBL31662343 0.77 DGAT1 (0.34) MAPTHPGDSPDE4DRAB9AKDM4E
SCHEMBL31662148 0.76 BTK (0.37) L3MBTL1RAB9AMEN1NPC1KMT2A
SCHEMBL31662277 0.74 MAPT (0.38) MAPTHPGDSL3MBTL1TDP1RAB9A
SCHEMBL31662261 0.74 MAPT (0.34) MAPTHPGDSL3MBTL1TDP1RAB9A
SCHEMBL31662303 0.74 CHEK1 (0.39) MAPT
SCHEMBL31662302 0.74 CHEK1 (0.39) MAPT
SCHEMBL31662770 0.74 CD38 (0.36) CD38MAPTPDE4BLRRK2

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