SCHEMBL11527161

SCHEMBL11527161

COc1cc(OCC(=O)Oc2ccc(O)c(OC)c2)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.55
LMNA P02545 2/20 0.53
TDP1 Q9NUW8 4/20 0.50
NPC1 O15118 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.47
RAB9A P51151 1/20 0.47
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NFKB1 P19838 2/20 0.46
HTT P42858 2/20 0.46
APP P05067 2/20 0.46
MAOB P27338 2/20 0.44
ATM Q13315 1/20 0.44
HSD17B2 P37059 2/20 0.44
CYP2D6 P10635 2/20 0.43
CYP2C9 P11712 2/20 0.43

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
SCHEMBL2127610 0.84 KMT2A (0.50) GAALMNATDP1MEN1KMT2A
SCHEMBL4791444 0.83 TSHR (0.50) GAALMNATDP1MEN1KMT2A
SCHEMBL8838326 0.81 KDM4E (0.49) GAALMNATDP1MEN1KMT2A
SCHEMBL377390 0.78 SLC22A6 (0.55) GAALMNATDP1MEN1KMT2A
SCHEMBL19718941 0.78 MAPT (0.51) GAALMNANPC1L3MBTL1MEN1
SCHEMBL11528338 0.78 NPC1 (0.49) GAALMNATDP1NPC1L3MBTL1
SCHEMBL11525514 0.78 L3MBTL1 (0.65) GAALMNATDP1NPC1L3MBTL1
SCHEMBL28945284 0.77 MEN1 (0.53) GAALMNATDP1MEN1KMT2A
SCHEMBL6495895 0.76 BCHE (0.54) GAALMNAMEN1KMT2ASLC22A6
SCHEMBL1645317 0.76 TUBB4A (0.55) GAALMNAMEN1KMT2AALDH1A1

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
US-4163759-A Process for preparing aromatic hydroxyaldehydes HAARMANN & REIMER GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1979-08-07 US disclosed