SCHEMBL11208174

SCHEMBL11208174

COc1ccc(C(=O)c2ccc(O)c(N)c2O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.54
RAB9A P51151 4/20 0.54
MAPT P10636 8/20 0.52
HPGD P15428 4/20 0.52
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
ALOX15 P16050 3/20 0.52
HSD17B10 Q99714 3/20 0.52
RECQL P46063 2/20 0.52
MAPK1 P28482 4/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 3/20 0.51
CYP1A2 P05177 1/20 0.51
PGR P06401 1/20 0.51
CYP2D6 P10635 1/20 0.51
SLC6A2 P23975 1/20 0.51
PDE4A P27815 1/20 0.51
CYP2C19 P33261 1/20 0.51
HRH1 P35367 1/20 0.51
SLC6A3 Q01959 1/20 0.51

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
SCHEMBL93601 0.85 MAPT (0.69) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL11218165 0.83 NPC1 (0.55) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL30506538 0.83 NPC1 (0.55) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL29215654 0.83 NPC1 (0.55) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL5134949 0.81 KMT2A (0.59) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL11206662 0.79 RAB9A (0.50) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL11214191 0.78 MAPT (0.53) MAPTHPGDKDM4EALDH1A1ALOX15
SCHEMBL11213945 0.78 MAPT (0.57) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL11213117 0.78 NPC1 (0.50) NPC1RAB9AMAPTHPGDKDM4E
SCHEMBL93245 0.78 MAPT (0.79) NPC1RAB9AMAPTHPGDKDM4E

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
EP-0079141-A1 Aminoresorcinol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1983-05-18 EP disclosed